(3R)-N-(4-cyclopentyloxyphenyl)-3-[(2S)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide

C24H30N2O4 — CID 97014789

IUPAC(3R)-N-(4-cyclopentyloxyphenyl)-3-[(2S)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide
SMILESO=C(Nc1ccc(OC2CCCC2)cc1)N1CCOC[C@H]1C[C@H](O)c1ccccc1
InChIInChI=1S/C24H30N2O4/c27-23(18-6-2-1-3-7-18)16-20-17-29-15-14-26(20)24(28)25-19-10-12-22(13-11-19)30-21-8-4-5-9-21/h1-3,6-7,10-13,20-21,23,27H,4-5,8-9,14-17H2,(H,25,28)/t20-,23+/m1/s1
InChIKeyOVLPLWIFZGOFNP-OFNKIYASSA-N
MW410.51 g/mol
LogP4.36
Rot. Bonds6

About (3R)-N-(4-cyclopentyloxyphenyl)-3-[(2S)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide

(3R)-N-(4-cyclopentyloxyphenyl)-3-[(2S)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide (PubChem CID 97014789) has the molecular formula C24H30N2O4 and a molecular weight of 410.51 g/mol. Its IUPAC name is (3R)-N-(4-cyclopentyloxyphenyl)-3-[(2S)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name(3R)-N-(4-cyclopentyloxyphenyl)-3-[(2S)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide
PubChem CID97014789
Molecular FormulaC24H30N2O4
Molecular Weight410.51 g/mol
Exact Mass410.22
IUPAC Name(3R)-N-(4-cyclopentyloxyphenyl)-3-[(2S)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide
SMILESO=C(Nc1ccc(OC2CCCC2)cc1)N1CCOC[C@H]1C[C@H](O)c1ccccc1
InChIInChI=1S/C24H30N2O4/c27-23(18-6-2-1-3-7-18)16-20-17-29-15-14-26(20)24(28)25-19-10-12-22(13-11-19)30-21-8-4-5-9-21/h1-3,6-7,10-13,20-21,23,27H,4-5,8-9,14-17H2,(H,25,28)/t20-,23+/m1/s1
InChIKeyOVLPLWIFZGOFNP-OFNKIYASSA-N
XLogP4.36
TPSA71.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.51
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(3S)-N-(4-acetamido-3-methoxyphenyl)-3-[(2R)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide
CID 97058385
(3S)-3-[(2S)-2-hydroxy-2-phenylethyl]-N-[2-(N-methylanilino)phenyl]morpholine-4-carboxamide
CID 97061516
N-(2-cyclopropylethyl)-3-(2-hydroxy-2-phenylethyl)morpholine-4-carboxamide
CID 109499752
1-[3-(2-hydroxy-2-phenylethyl)morpholin-4-yl]prop-2-en-1-one
CID 166406225
(3S)-3-(2-methylpropyl)-N-phenylmorpholine-4-carboxamide
CID 95904890
N-[(1-cyclopropylcyclopropyl)methyl]-3-(2-hydroxy-2-phenylethyl)morpholine-4-carboxamide
CID 109499793
(5R)-N-(4-cyclopentyloxyphenyl)-5-methyl-1,4-oxazepane-4-carboxamide
CID 97333817
(3S)-N-(furan-2-ylmethyl)-3-[(2S)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide
CID 97014787
N-[4-(2-methylpropanoylamino)phenyl]-3-(2-methylpropyl)morpholine-4-carboxamide
CID 56794682
(3R)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-3-[(2R)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide
CID 96997622
2-(2-hydroxypropyl)-N-phenylpiperidine-1-carboxamide
CID 79539071
(3R)-3-[(2S)-2-hydroxy-2-thiophen-2-ylethyl]-N-(3-methoxyphenyl)morpholine-4-carboxamide
CID 96535639

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(4-cyclopentyloxyphenyl)-3-[(2S)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide?
The IUPAC name of (3R)-N-(4-cyclopentyloxyphenyl)-3-[(2S)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide (CID 97014789) is (3R)-N-(4-cyclopentyloxyphenyl)-3-[(2S)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide.
What is the SMILES notation for (3R)-N-(4-cyclopentyloxyphenyl)-3-[(2S)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide?
The canonical SMILES for (3R)-N-(4-cyclopentyloxyphenyl)-3-[(2S)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide is O=C(Nc1ccc(OC2CCCC2)cc1)N1CCOC[C@H]1C[C@H](O)c1ccccc1.
What is the InChIKey of (3R)-N-(4-cyclopentyloxyphenyl)-3-[(2S)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide?
The InChIKey is OVLPLWIFZGOFNP-OFNKIYASSA-N. The full InChI is InChI=1S/C24H30N2O4/c27-23(18-6-2-1-3-7-18)16-20-17-29-15-14-26(20)24(28)25-19-10-12-22(13-11-19)30-21-8-4-5-9-21/h1-3,6-7,10-13,20-21,23,27H,4-5,8-9,14-17H2,(H,25,28)/t20-,23+/m1/s1.
What are the key properties of (3R)-N-(4-cyclopentyloxyphenyl)-3-[(2S)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide?
(3R)-N-(4-cyclopentyloxyphenyl)-3-[(2S)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide has a molecular weight of 410.51 g/mol, XLogP of 4.36, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(4-cyclopentyloxyphenyl)-3-[(2S)-2-hydroxy-2-phenylethyl]morpholine-4-carboxamide is sourced from PubChem (CID 97014789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).