(4-methoxyphenyl) N-ethyl-N-[[4-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]cyclopropyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(Z)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[4-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-ynyl]phenyl]methyl]carbamate

C151H150N10O20 — CID 159898020

IUPAC(4-methoxyphenyl) N-ethyl-N-[[4-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]cyclopropyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(Z)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[4-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-ynyl]phenyl]methyl]carbamate
SMILESCCN(Cc1ccc(/C=C/Cc2nc(-c3ccccc3)oc2C)cc1)C(=O)Oc1ccc(OC)cc1.CCN(Cc1ccc(C2CC2Cc2nc(-c3ccccc3)oc2C)cc1)C(=O)Oc1ccc(OC)cc1.CCN(Cc1cccc(/C=C/Cc2nc(-c3ccccc3)oc2C)c1)C(=O)Oc1ccc(OC)cc1.CCN(Cc1cccc(/C=C\Cc2nc(-c3ccccc3)oc2C)c1)C(=O)Oc1ccc(OC)cc1.CCN(Cc1cccc(C#CCc2nc(-c3ccccc3)oc2C)c1)C(=O)Oc1ccc(OC)cc1
InChIInChI=1S/C31H32N2O4.2C30H30N2O4.C30H28N2O4.C30H30N2O4/c1-4-33(31(34)37-27-16-14-26(35-3)15-17-27)20-22-10-12-23(13-11-22)28-18-25(28)19-29-21(2)36-30(32-29)24-8-6-5-7-9-24;3*1-4-32(30(33)36-27-18-16-26(34-3)17-19-27)21-24-12-8-10-23(20-24)11-9-15-28-22(2)35-29(31-28)25-13-6-5-7-14-25;1-4-32(30(33)36-27-19-17-26(34-3)18-20-27)21-24-15-13-23(14-16-24)9-8-12-28-22(2)35-29(31-28)25-10-6-5-7-11-25/h5-17,25,28H,4,18-20H2,1-3H3;2*5-14,16-20H,4,15,21H2,1-3H3;5-8,10,12-14,16-20H,4,15,21H2,1-3H3;5-11,13-20H,4,12,21H2,1-3H3/b;11-9+;11-9-;;9-8+
InChIKeyNVPCJTXFGKRWDQ-WYZGKNCWSA-N
MW2424.91 g/mol
LogP34.11
Rot. Bonds43

About (4-methoxyphenyl) N-ethyl-N-[[4-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]cyclopropyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(Z)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[4-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-ynyl]phenyl]methyl]carbamate

(4-methoxyphenyl) N-ethyl-N-[[4-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]cyclopropyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(Z)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[4-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-ynyl]phenyl]methyl]carbamate (PubChem CID 159898020) has the molecular formula C151H150N10O20 and a molecular weight of 2424.91 g/mol. Its IUPAC name is (4-methoxyphenyl) N-ethyl-N-[[4-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]cyclopropyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(Z)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[4-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-ynyl]phenyl]methyl]carbamate.

Molecular Properties

Compound Name(4-methoxyphenyl) N-ethyl-N-[[4-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]cyclopropyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(Z)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[4-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-ynyl]phenyl]methyl]carbamate
PubChem CID159898020
Molecular FormulaC151H150N10O20
Molecular Weight2424.91 g/mol
Exact Mass2423.10
IUPAC Name(4-methoxyphenyl) N-ethyl-N-[[4-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]cyclopropyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(Z)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[4-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-ynyl]phenyl]methyl]carbamate
SMILESCCN(Cc1ccc(/C=C/Cc2nc(-c3ccccc3)oc2C)cc1)C(=O)Oc1ccc(OC)cc1.CCN(Cc1ccc(C2CC2Cc2nc(-c3ccccc3)oc2C)cc1)C(=O)Oc1ccc(OC)cc1.CCN(Cc1cccc(/C=C/Cc2nc(-c3ccccc3)oc2C)c1)C(=O)Oc1ccc(OC)cc1.CCN(Cc1cccc(/C=C\Cc2nc(-c3ccccc3)oc2C)c1)C(=O)Oc1ccc(OC)cc1.CCN(Cc1cccc(C#CCc2nc(-c3ccccc3)oc2C)c1)C(=O)Oc1ccc(OC)cc1
InChIInChI=1S/C31H32N2O4.2C30H30N2O4.C30H28N2O4.C30H30N2O4/c1-4-33(31(34)37-27-16-14-26(35-3)15-17-27)20-22-10-12-23(13-11-22)28-18-25(28)19-29-21(2)36-30(32-29)24-8-6-5-7-9-24;3*1-4-32(30(33)36-27-18-16-26(34-3)17-19-27)21-24-12-8-10-23(20-24)11-9-15-28-22(2)35-29(31-28)25-13-6-5-7-14-25;1-4-32(30(33)36-27-19-17-26(34-3)18-20-27)21-24-15-13-23(14-16-24)9-8-12-28-22(2)35-29(31-28)25-10-6-5-7-11-25/h5-17,25,28H,4,18-20H2,1-3H3;2*5-14,16-20H,4,15,21H2,1-3H3;5-8,10,12-14,16-20H,4,15,21H2,1-3H3;5-11,13-20H,4,12,21H2,1-3H3/b;11-9+;11-9-;;9-8+
InChIKeyNVPCJTXFGKRWDQ-WYZGKNCWSA-N
XLogP34.11
TPSA324.00 Ų
H-Bond Donors
H-Bond Acceptors25
Rotatable Bonds43
Heavy Atoms181
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002424.91
LogP ≤ 534.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze (4-methoxyphenyl) N-ethyl-N-[[4-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]cyclopropyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(Z)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[4-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-ynyl]phenyl]methyl]carbamate with MolForge

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Frequently Asked Questions

What is the IUPAC name of (4-methoxyphenyl) N-ethyl-N-[[4-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]cyclopropyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(Z)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[4-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-ynyl]phenyl]methyl]carbamate?
The IUPAC name of (4-methoxyphenyl) N-ethyl-N-[[4-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]cyclopropyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(Z)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[4-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-ynyl]phenyl]methyl]carbamate (CID 159898020) is (4-methoxyphenyl) N-ethyl-N-[[4-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]cyclopropyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(Z)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[4-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-ynyl]phenyl]methyl]carbamate.
What is the SMILES notation for (4-methoxyphenyl) N-ethyl-N-[[4-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]cyclopropyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(Z)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[4-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-ynyl]phenyl]methyl]carbamate?
The canonical SMILES for (4-methoxyphenyl) N-ethyl-N-[[4-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]cyclopropyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(Z)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[4-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-ynyl]phenyl]methyl]carbamate is CCN(Cc1ccc(/C=C/Cc2nc(-c3ccccc3)oc2C)cc1)C(=O)Oc1ccc(OC)cc1.CCN(Cc1ccc(C2CC2Cc2nc(-c3ccccc3)oc2C)cc1)C(=O)Oc1ccc(OC)cc1.CCN(Cc1cccc(/C=C/Cc2nc(-c3ccccc3)oc2C)c1)C(=O)Oc1ccc(OC)cc1.CCN(Cc1cccc(/C=C\Cc2nc(-c3ccccc3)oc2C)c1)C(=O)Oc1ccc(OC)cc1.CCN(Cc1cccc(C#CCc2nc(-c3ccccc3)oc2C)c1)C(=O)Oc1ccc(OC)cc1.
What is the InChIKey of (4-methoxyphenyl) N-ethyl-N-[[4-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]cyclopropyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(Z)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[4-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-ynyl]phenyl]methyl]carbamate?
The InChIKey is NVPCJTXFGKRWDQ-WYZGKNCWSA-N. The full InChI is InChI=1S/C31H32N2O4.2C30H30N2O4.C30H28N2O4.C30H30N2O4/c1-4-33(31(34)37-27-16-14-26(35-3)15-17-27)20-22-10-12-23(13-11-22)28-18-25(28)19-29-21(2)36-30(32-29)24-8-6-5-7-9-24;3*1-4-32(30(33)36-27-18-16-26(34-3)17-19-27)21-24-12-8-10-23(20-24)11-9-15-28-22(2)35-29(31-28)25-13-6-5-7-14-25;1-4-32(30(33)36-27-19-17-26(34-3)18-20-27)21-24-15-13-23(14-16-24)9-8-12-28-22(2)35-29(31-28)25-10-6-5-7-11-25/h5-17,25,28H,4,18-20H2,1-3H3;2*5-14,16-20H,4,15,21H2,1-3H3;5-8,10,12-14,16-20H,4,15,21H2,1-3H3;5-11,13-20H,4,12,21H2,1-3H3/b;11-9+;11-9-;;9-8+.
What are the key properties of (4-methoxyphenyl) N-ethyl-N-[[4-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]cyclopropyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(Z)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[4-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-ynyl]phenyl]methyl]carbamate?
(4-methoxyphenyl) N-ethyl-N-[[4-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]cyclopropyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(Z)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[4-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-ynyl]phenyl]methyl]carbamate has a molecular weight of 2424.91 g/mol, XLogP of 34.11, 43 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl) N-ethyl-N-[[4-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]cyclopropyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(Z)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[4-[(E)-3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-enyl]phenyl]methyl]carbamate;(4-methoxyphenyl) N-ethyl-N-[[3-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)prop-1-ynyl]phenyl]methyl]carbamate is sourced from PubChem (CID 159898020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).