2-[ethyl(methyl)amino]-N-(1-phenylbutyl)propanamide

C16H26N2O — CID 60516767

IUPAC2-[ethyl(methyl)amino]-N-(1-phenylbutyl)propanamide
SMILESCCCC(NC(=O)C(C)N(C)CC)c1ccccc1
InChIInChI=1S/C16H26N2O/c1-5-10-15(14-11-8-7-9-12-14)17-16(19)13(3)18(4)6-2/h7-9,11-13,15H,5-6,10H2,1-4H3,(H,17,19)
InChIKeyPSCJSTLTMAICKV-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.98
Rot. Bonds7

About 2-[ethyl(methyl)amino]-N-(1-phenylbutyl)propanamide

2-[ethyl(methyl)amino]-N-(1-phenylbutyl)propanamide (PubChem CID 60516767) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-[ethyl(methyl)amino]-N-(1-phenylbutyl)propanamide.

Molecular Properties

Compound Name2-[ethyl(methyl)amino]-N-(1-phenylbutyl)propanamide
PubChem CID60516767
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2-[ethyl(methyl)amino]-N-(1-phenylbutyl)propanamide
SMILESCCCC(NC(=O)C(C)N(C)CC)c1ccccc1
InChIInChI=1S/C16H26N2O/c1-5-10-15(14-11-8-7-9-12-14)17-16(19)13(3)18(4)6-2/h7-9,11-13,15H,5-6,10H2,1-4H3,(H,17,19)
InChIKeyPSCJSTLTMAICKV-UHFFFAOYSA-N
XLogP2.98
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-[(1S)-1-phenylbutyl]propanamide
CID 8914313
2-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-N-(1-phenylbutyl)propanamide
CID 84832187
(2R)-2-chloro-N-[(1S)-1-phenylbutyl]propanamide
CID 2466708
(2S)-2-[methyl-[2-(2-methylsulfanylanilino)-2-oxoethyl]amino]-N-[(1R)-1-phenylbutyl]propanamide
CID 9348098
2-[methyl-[2-(2-methylsulfanylanilino)-2-oxoethyl]amino]-N-(1-phenylbutyl)propanamide
CID 60516440
(2S)-2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-[(1R)-1-phenylbutyl]propanamide
CID 9348881
(2S)-2-[[2-(3-methoxyanilino)-2-oxoethyl]-methylamino]-N-[(1S)-1-phenylbutyl]propanamide
CID 8556646
1-phenylbutylurea
CID 2852079
2-(4-fluoroanilino)-N-(1-phenylbutyl)propanamide
CID 134030963
N-[(1R)-2-hydroxy-1-phenylethyl]-2-methylpentanamide
CID 113258887
(2S)-2-(4-acetylpiperazin-1-yl)-N-[(1S)-1-phenylbutyl]propanamide
CID 9276310
4-fluoro-N-(1-phenylbutyl)benzamide
CID 60657146

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(methyl)amino]-N-(1-phenylbutyl)propanamide?
The IUPAC name of 2-[ethyl(methyl)amino]-N-(1-phenylbutyl)propanamide (CID 60516767) is 2-[ethyl(methyl)amino]-N-(1-phenylbutyl)propanamide.
What is the SMILES notation for 2-[ethyl(methyl)amino]-N-(1-phenylbutyl)propanamide?
The canonical SMILES for 2-[ethyl(methyl)amino]-N-(1-phenylbutyl)propanamide is CCCC(NC(=O)C(C)N(C)CC)c1ccccc1.
What is the InChIKey of 2-[ethyl(methyl)amino]-N-(1-phenylbutyl)propanamide?
The InChIKey is PSCJSTLTMAICKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-5-10-15(14-11-8-7-9-12-14)17-16(19)13(3)18(4)6-2/h7-9,11-13,15H,5-6,10H2,1-4H3,(H,17,19).
What are the key properties of 2-[ethyl(methyl)amino]-N-(1-phenylbutyl)propanamide?
2-[ethyl(methyl)amino]-N-(1-phenylbutyl)propanamide has a molecular weight of 262.40 g/mol, XLogP of 2.98, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(methyl)amino]-N-(1-phenylbutyl)propanamide is sourced from PubChem (CID 60516767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).