(2S)-N-(2-methoxyphenyl)-2-[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]propanamide

C24H26N2O3 — CID 39948957

IUPAC(2S)-N-(2-methoxyphenyl)-2-[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]propanamide
SMILESCOc1ccc([C@H](N[C@@H](C)C(=O)Nc2ccccc2OC)c2ccccc2)cc1
InChIInChI=1S/C24H26N2O3/c1-17(24(27)26-21-11-7-8-12-22(21)29-3)25-23(18-9-5-4-6-10-18)19-13-15-20(28-2)16-14-19/h4-17,23,25H,1-3H3,(H,26,27)/t17-,23+/m0/s1
InChIKeyUQOVJZDWPCKXKZ-GAJHUEQPSA-N
MW390.48 g/mol
LogP4.41
Rot. Bonds8

About (2S)-N-(2-methoxyphenyl)-2-[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]propanamide

(2S)-N-(2-methoxyphenyl)-2-[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]propanamide (PubChem CID 39948957) has the molecular formula C24H26N2O3 and a molecular weight of 390.48 g/mol. Its IUPAC name is (2S)-N-(2-methoxyphenyl)-2-[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]propanamide.

Molecular Properties

Compound Name(2S)-N-(2-methoxyphenyl)-2-[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]propanamide
PubChem CID39948957
Molecular FormulaC24H26N2O3
Molecular Weight390.48 g/mol
Exact Mass390.19
IUPAC Name(2S)-N-(2-methoxyphenyl)-2-[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]propanamide
SMILESCOc1ccc([C@H](N[C@@H](C)C(=O)Nc2ccccc2OC)c2ccccc2)cc1
InChIInChI=1S/C24H26N2O3/c1-17(24(27)26-21-11-7-8-12-22(21)29-3)25-23(18-9-5-4-6-10-18)19-13-15-20(28-2)16-14-19/h4-17,23,25H,1-3H3,(H,26,27)/t17-,23+/m0/s1
InChIKeyUQOVJZDWPCKXKZ-GAJHUEQPSA-N
XLogP4.41
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.48
LogP ≤ 54.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxyphenyl)-2-[[(4-methoxyphenyl)-phenylmethyl]amino]propanamide
CID 42918152
2-(4-methoxyanilino)-N-(2-methoxyphenyl)propanamide
CID 17397275
(2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide
CID 8545508
(2R)-N-(3,5-dimethoxyphenyl)-2-[[(R)-(4-methylphenyl)-phenylmethyl]amino]propanamide
CID 8001713
(2R)-2-(4-methoxyphenoxy)-N-(2-methoxyphenyl)propanamide
CID 925101
(2R)-2-(benzhydrylamino)-N-(4-methoxy-2-nitrophenyl)propanamide
CID 9445757
(2S)-2-(benzhydrylamino)-N-(3,4-dimethoxyphenyl)propanamide
CID 9445871
N-(2-methoxyphenyl)-2-[[(R)-(4-methylphenyl)-phenylmethyl]amino]acetamide
CID 9392871
(2R)-2-(benzhydrylamino)-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 9445831
(2S)-2-(benzhydrylamino)-N-[(2-methoxyphenyl)methyl]propanamide
CID 9445893
[(2S)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (3S)-3-phenylbutanoate
CID 7265946
(2S)-N-(2-methoxyphenyl)-2-[[(1S)-1-(4-sulfamoylphenyl)ethyl]amino]propanamide
CID 30825134

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2-methoxyphenyl)-2-[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]propanamide?
The IUPAC name of (2S)-N-(2-methoxyphenyl)-2-[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]propanamide (CID 39948957) is (2S)-N-(2-methoxyphenyl)-2-[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]propanamide.
What is the SMILES notation for (2S)-N-(2-methoxyphenyl)-2-[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]propanamide?
The canonical SMILES for (2S)-N-(2-methoxyphenyl)-2-[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]propanamide is COc1ccc([C@H](N[C@@H](C)C(=O)Nc2ccccc2OC)c2ccccc2)cc1.
What is the InChIKey of (2S)-N-(2-methoxyphenyl)-2-[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]propanamide?
The InChIKey is UQOVJZDWPCKXKZ-GAJHUEQPSA-N. The full InChI is InChI=1S/C24H26N2O3/c1-17(24(27)26-21-11-7-8-12-22(21)29-3)25-23(18-9-5-4-6-10-18)19-13-15-20(28-2)16-14-19/h4-17,23,25H,1-3H3,(H,26,27)/t17-,23+/m0/s1.
What are the key properties of (2S)-N-(2-methoxyphenyl)-2-[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]propanamide?
(2S)-N-(2-methoxyphenyl)-2-[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]propanamide has a molecular weight of 390.48 g/mol, XLogP of 4.41, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2-methoxyphenyl)-2-[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]propanamide is sourced from PubChem (CID 39948957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).