N-cyclopropyl-N-[[3-(3-methylphenyl)-5-morpholin-4-yl-1,2-oxazol-4-yl]methyl]cyclopentanecarboxamide

C24H31N3O3 — CID 42682742

IUPACN-cyclopropyl-N-[[3-(3-methylphenyl)-5-morpholin-4-yl-1,2-oxazol-4-yl]methyl]cyclopentanecarboxamide
SMILESCc1cccc(-c2noc(N3CCOCC3)c2CN(C(=O)C2CCCC2)C2CC2)c1
InChIInChI=1S/C24H31N3O3/c1-17-5-4-8-19(15-17)22-21(24(30-25-22)26-11-13-29-14-12-26)16-27(20-9-10-20)23(28)18-6-2-3-7-18/h4-5,8,15,18,20H,2-3,6-7,9-14,16H2,1H3
InChIKeyKSJBJXQNYCASSI-UHFFFAOYSA-N
MW409.53 g/mol
LogP4.17
Rot. Bonds6

About N-cyclopropyl-N-[[3-(3-methylphenyl)-5-morpholin-4-yl-1,2-oxazol-4-yl]methyl]cyclopentanecarboxamide

N-cyclopropyl-N-[[3-(3-methylphenyl)-5-morpholin-4-yl-1,2-oxazol-4-yl]methyl]cyclopentanecarboxamide (PubChem CID 42682742) has the molecular formula C24H31N3O3 and a molecular weight of 409.53 g/mol. Its IUPAC name is N-cyclopropyl-N-[[3-(3-methylphenyl)-5-morpholin-4-yl-1,2-oxazol-4-yl]methyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[[3-(3-methylphenyl)-5-morpholin-4-yl-1,2-oxazol-4-yl]methyl]cyclopentanecarboxamide
PubChem CID42682742
Molecular FormulaC24H31N3O3
Molecular Weight409.53 g/mol
Exact Mass409.24
IUPAC NameN-cyclopropyl-N-[[3-(3-methylphenyl)-5-morpholin-4-yl-1,2-oxazol-4-yl]methyl]cyclopentanecarboxamide
SMILESCc1cccc(-c2noc(N3CCOCC3)c2CN(C(=O)C2CCCC2)C2CC2)c1
InChIInChI=1S/C24H31N3O3/c1-17-5-4-8-19(15-17)22-21(24(30-25-22)26-11-13-29-14-12-26)16-27(20-9-10-20)23(28)18-6-2-3-7-18/h4-5,8,15,18,20H,2-3,6-7,9-14,16H2,1H3
InChIKeyKSJBJXQNYCASSI-UHFFFAOYSA-N
XLogP4.17
TPSA58.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.53
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-cyclopropyl-N-[[3-(3-methylphenyl)-5-morpholin-4-yl-1,2-oxazol-4-yl]methyl]cyclopentanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[[3-(3-methylphenyl)-5-morpholin-4-yl-1,2-oxazol-4-yl]methyl]cyclopentanecarboxamide?
The IUPAC name of N-cyclopropyl-N-[[3-(3-methylphenyl)-5-morpholin-4-yl-1,2-oxazol-4-yl]methyl]cyclopentanecarboxamide (CID 42682742) is N-cyclopropyl-N-[[3-(3-methylphenyl)-5-morpholin-4-yl-1,2-oxazol-4-yl]methyl]cyclopentanecarboxamide.
What is the SMILES notation for N-cyclopropyl-N-[[3-(3-methylphenyl)-5-morpholin-4-yl-1,2-oxazol-4-yl]methyl]cyclopentanecarboxamide?
The canonical SMILES for N-cyclopropyl-N-[[3-(3-methylphenyl)-5-morpholin-4-yl-1,2-oxazol-4-yl]methyl]cyclopentanecarboxamide is Cc1cccc(-c2noc(N3CCOCC3)c2CN(C(=O)C2CCCC2)C2CC2)c1.
What is the InChIKey of N-cyclopropyl-N-[[3-(3-methylphenyl)-5-morpholin-4-yl-1,2-oxazol-4-yl]methyl]cyclopentanecarboxamide?
The InChIKey is KSJBJXQNYCASSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N3O3/c1-17-5-4-8-19(15-17)22-21(24(30-25-22)26-11-13-29-14-12-26)16-27(20-9-10-20)23(28)18-6-2-3-7-18/h4-5,8,15,18,20H,2-3,6-7,9-14,16H2,1H3.
What are the key properties of N-cyclopropyl-N-[[3-(3-methylphenyl)-5-morpholin-4-yl-1,2-oxazol-4-yl]methyl]cyclopentanecarboxamide?
N-cyclopropyl-N-[[3-(3-methylphenyl)-5-morpholin-4-yl-1,2-oxazol-4-yl]methyl]cyclopentanecarboxamide has a molecular weight of 409.53 g/mol, XLogP of 4.17, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[[3-(3-methylphenyl)-5-morpholin-4-yl-1,2-oxazol-4-yl]methyl]cyclopentanecarboxamide is sourced from PubChem (CID 42682742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).