N-(ethylcarbamoyl)-2-(4-phenylbutan-2-ylamino)propanamide

C16H25N3O2 — CID 60638721

IUPACN-(ethylcarbamoyl)-2-(4-phenylbutan-2-ylamino)propanamide
SMILESCCNC(=O)NC(=O)C(C)NC(C)CCc1ccccc1
InChIInChI=1S/C16H25N3O2/c1-4-17-16(21)19-15(20)13(3)18-12(2)10-11-14-8-6-5-7-9-14/h5-9,12-13,18H,4,10-11H2,1-3H3,(H2,17,19,20,21)
InChIKeyGIUIRTKMCNABDN-UHFFFAOYSA-N
MW291.40 g/mol
LogP1.83
Rot. Bonds7

About N-(ethylcarbamoyl)-2-(4-phenylbutan-2-ylamino)propanamide

N-(ethylcarbamoyl)-2-(4-phenylbutan-2-ylamino)propanamide (PubChem CID 60638721) has the molecular formula C16H25N3O2 and a molecular weight of 291.40 g/mol. Its IUPAC name is N-(ethylcarbamoyl)-2-(4-phenylbutan-2-ylamino)propanamide.

Molecular Properties

Compound NameN-(ethylcarbamoyl)-2-(4-phenylbutan-2-ylamino)propanamide
PubChem CID60638721
Molecular FormulaC16H25N3O2
Molecular Weight291.40 g/mol
Exact Mass291.19
IUPAC NameN-(ethylcarbamoyl)-2-(4-phenylbutan-2-ylamino)propanamide
SMILESCCNC(=O)NC(=O)C(C)NC(C)CCc1ccccc1
InChIInChI=1S/C16H25N3O2/c1-4-17-16(21)19-15(20)13(3)18-12(2)10-11-14-8-6-5-7-9-14/h5-9,12-13,18H,4,10-11H2,1-3H3,(H2,17,19,20,21)
InChIKeyGIUIRTKMCNABDN-UHFFFAOYSA-N
XLogP1.83
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 51.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-(ethylcarbamoyl)-2-(4-phenylbutan-2-ylamino)propanamide with MolForge

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

Launch Full Analysis

Related Compounds

2-(4-phenylbutan-2-ylamino)butanoic acid
CID 64669361
N,N-diethyl-2-(4-phenylbutan-2-ylamino)propanamide
CID 43425172
2-[2-aminoethyl(2-phenylethyl)amino]-N-(ethylcarbamoyl)propanamide
CID 120872420
2-[5-(diethylamino)pentan-2-ylamino]-N-(ethylcarbamoyl)propanamide
CID 43083671
N-[(2S)-4-phenylbutan-2-yl]acetamide
CID 6933208
N-(ethylcarbamoyl)-2-(2-pyridin-4-ylethylamino)propanamide
CID 60902698
N-(ethylcarbamoyl)-2-[2-(3-methylphenyl)ethylamino]propanamide
CID 62315197
(2S)-2-(methylamino)-N-[(2R)-4-phenylbutan-2-yl]propanamide
CID 143330073
2-[(1-benzylpyrazol-4-yl)amino]-N-(ethylcarbamoyl)propanamide
CID 75507073
N-(ethylcarbamoyl)-2-[[(1R)-1-pyridin-4-ylethyl]amino]propanamide
CID 81409955
N-(ethylcarbamoyl)-2-[[(1S)-1-(4-fluorophenyl)ethyl]amino]propanamide
CID 81347825
N-(ethylcarbamoyl)-2-[[(1S)-1-pyridin-4-ylethyl]amino]propanamide
CID 81406042

Frequently Asked Questions

What is the IUPAC name of N-(ethylcarbamoyl)-2-(4-phenylbutan-2-ylamino)propanamide?
The IUPAC name of N-(ethylcarbamoyl)-2-(4-phenylbutan-2-ylamino)propanamide (CID 60638721) is N-(ethylcarbamoyl)-2-(4-phenylbutan-2-ylamino)propanamide.
What is the SMILES notation for N-(ethylcarbamoyl)-2-(4-phenylbutan-2-ylamino)propanamide?
The canonical SMILES for N-(ethylcarbamoyl)-2-(4-phenylbutan-2-ylamino)propanamide is CCNC(=O)NC(=O)C(C)NC(C)CCc1ccccc1.
What is the InChIKey of N-(ethylcarbamoyl)-2-(4-phenylbutan-2-ylamino)propanamide?
The InChIKey is GIUIRTKMCNABDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-4-17-16(21)19-15(20)13(3)18-12(2)10-11-14-8-6-5-7-9-14/h5-9,12-13,18H,4,10-11H2,1-3H3,(H2,17,19,20,21).
What are the key properties of N-(ethylcarbamoyl)-2-(4-phenylbutan-2-ylamino)propanamide?
N-(ethylcarbamoyl)-2-(4-phenylbutan-2-ylamino)propanamide has a molecular weight of 291.40 g/mol, XLogP of 1.83, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethylcarbamoyl)-2-(4-phenylbutan-2-ylamino)propanamide is sourced from PubChem (CID 60638721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).