2-methyl-N-[2-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide

C19H24N2O3 — CID 95631821

IUPAC2-methyl-N-[2-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide
SMILESCc1ccccc1[C@@H](NC(=O)CNC(=O)c1ccoc1C)C(C)C
InChIInChI=1S/C19H24N2O3/c1-12(2)18(15-8-6-5-7-13(15)3)21-17(22)11-20-19(23)16-9-10-24-14(16)4/h5-10,12,18H,11H2,1-4H3,(H,20,23)(H,21,22)/t18-/m0/s1
InChIKeyUGDAERKDCBFCEE-SFHVURJKSA-N
MW328.41 g/mol
LogP3.14
Rot. Bonds6

About 2-methyl-N-[2-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide

2-methyl-N-[2-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide (PubChem CID 95631821) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 2-methyl-N-[2-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[2-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide
PubChem CID95631821
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name2-methyl-N-[2-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide
SMILESCc1ccccc1[C@@H](NC(=O)CNC(=O)c1ccoc1C)C(C)C
InChIInChI=1S/C19H24N2O3/c1-12(2)18(15-8-6-5-7-13(15)3)21-17(22)11-20-19(23)16-9-10-24-14(16)4/h5-10,12,18H,11H2,1-4H3,(H,20,23)(H,21,22)/t18-/m0/s1
InChIKeyUGDAERKDCBFCEE-SFHVURJKSA-N
XLogP3.14
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[2-oxo-2-(propylamino)ethyl]furan-3-carboxamide
CID 35352937
N-[2-[(3-hydroxy-2,2,4-trimethylpentyl)amino]-2-oxoethyl]-2-methylfuran-3-carboxamide
CID 109389252
2-(2-methoxyethylamino)-N-[2-methyl-1-(2-methylphenyl)propyl]acetamide;hydrochloride
CID 119782792
2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide
CID 94488168
2-methyl-N-[2-[[2-[[methyl(propan-2-yl)amino]methyl]phenyl]methylamino]-2-oxoethyl]furan-3-carboxamide
CID 55837756
N-(2,2-diphenylethyl)-2-methylfuran-3-carboxamide
CID 78808962
N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide
CID 42910539
1-(2-hydroxyethyl)-3-[2-methyl-1-(2-methylphenyl)propyl]urea
CID 111118152
N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-2-methylfuran-3-carboxamide
CID 27859031
5-(acetamidomethyl)-N-[(1S)-2-methyl-1-(2-methylphenyl)propyl]furan-2-carboxamide
CID 96525205
N-[3-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-3-oxopropyl]pyrazine-2-carboxamide
CID 97212613
5-methyl-3-[[(2-methylfuran-3-carbonyl)amino]methyl]hexanoic acid
CID 65494748

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide?
The IUPAC name of 2-methyl-N-[2-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide (CID 95631821) is 2-methyl-N-[2-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[2-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide?
The canonical SMILES for 2-methyl-N-[2-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide is Cc1ccccc1[C@@H](NC(=O)CNC(=O)c1ccoc1C)C(C)C.
What is the InChIKey of 2-methyl-N-[2-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide?
The InChIKey is UGDAERKDCBFCEE-SFHVURJKSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-12(2)18(15-8-6-5-7-13(15)3)21-17(22)11-20-19(23)16-9-10-24-14(16)4/h5-10,12,18H,11H2,1-4H3,(H,20,23)(H,21,22)/t18-/m0/s1.
What are the key properties of 2-methyl-N-[2-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide?
2-methyl-N-[2-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide has a molecular weight of 328.41 g/mol, XLogP of 3.14, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide is sourced from PubChem (CID 95631821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).