N-(2-ethyl-1-phenylbutyl)-2-(methylamino)propanamide

C16H26N2O — CID 62637480

IUPACN-(2-ethyl-1-phenylbutyl)-2-(methylamino)propanamide
SMILESCCC(CC)C(NC(=O)C(C)NC)c1ccccc1
InChIInChI=1S/C16H26N2O/c1-5-13(6-2)15(14-10-8-7-9-11-14)18-16(19)12(3)17-4/h7-13,15,17H,5-6H2,1-4H3,(H,18,19)
InChIKeyCCACRNFWEZEEQV-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.89
Rot. Bonds7

About N-(2-ethyl-1-phenylbutyl)-2-(methylamino)propanamide

N-(2-ethyl-1-phenylbutyl)-2-(methylamino)propanamide (PubChem CID 62637480) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N-(2-ethyl-1-phenylbutyl)-2-(methylamino)propanamide.

Molecular Properties

Compound NameN-(2-ethyl-1-phenylbutyl)-2-(methylamino)propanamide
PubChem CID62637480
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN-(2-ethyl-1-phenylbutyl)-2-(methylamino)propanamide
SMILESCCC(CC)C(NC(=O)C(C)NC)c1ccccc1
InChIInChI=1S/C16H26N2O/c1-5-13(6-2)15(14-10-8-7-9-11-14)18-16(19)12(3)17-4/h7-13,15,17H,5-6H2,1-4H3,(H,18,19)
InChIKeyCCACRNFWEZEEQV-UHFFFAOYSA-N
XLogP2.89
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(methylamino)-N-(1-phenylpropyl)propanamide
CID 165438311
3-amino-N-(2-ethyl-1-phenylbutyl)-2-methylpropanamide
CID 62669442
2-(methylamino)-N-[(1S)-1-phenylethyl]propanamide
CID 63870086
2-(methylamino)-N-[(1R)-1-phenylethyl]propanamide
CID 78953244
N-(2-ethyl-1-phenylbutyl)but-2-enamide
CID 112729313
tert-butyl N-(2-ethyl-1-phenylbutyl)carbamate
CID 18378512
(2S)-2-(methylamino)-N-[(2R)-4-phenylbutan-2-yl]propanamide
CID 143330073
N-(2-ethyl-1-phenylbutyl)-1H-pyrazole-4-carboxamide
CID 61259747
5-bromo-N-(2-ethyl-1-phenylbutyl)furan-2-carboxamide
CID 63524768
3-(3-ethylpentan-2-ylamino)-2-phenylpropanoic acid
CID 64559425
(2S)-2-methyl-N-[(1S)-1-phenylethyl]butanamide
CID 16753350
N-benzyl-2-ethyl-1-phenylbutan-1-amine
CID 43734682

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-1-phenylbutyl)-2-(methylamino)propanamide?
The IUPAC name of N-(2-ethyl-1-phenylbutyl)-2-(methylamino)propanamide (CID 62637480) is N-(2-ethyl-1-phenylbutyl)-2-(methylamino)propanamide.
What is the SMILES notation for N-(2-ethyl-1-phenylbutyl)-2-(methylamino)propanamide?
The canonical SMILES for N-(2-ethyl-1-phenylbutyl)-2-(methylamino)propanamide is CCC(CC)C(NC(=O)C(C)NC)c1ccccc1.
What is the InChIKey of N-(2-ethyl-1-phenylbutyl)-2-(methylamino)propanamide?
The InChIKey is CCACRNFWEZEEQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-5-13(6-2)15(14-10-8-7-9-11-14)18-16(19)12(3)17-4/h7-13,15,17H,5-6H2,1-4H3,(H,18,19).
What are the key properties of N-(2-ethyl-1-phenylbutyl)-2-(methylamino)propanamide?
N-(2-ethyl-1-phenylbutyl)-2-(methylamino)propanamide has a molecular weight of 262.40 g/mol, XLogP of 2.89, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-1-phenylbutyl)-2-(methylamino)propanamide is sourced from PubChem (CID 62637480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).