2-amino-N-ethyl-N-(1-phenylbutan-2-yl)pentanamide

C17H28N2O — CID 119337188

IUPAC2-amino-N-ethyl-N-(1-phenylbutan-2-yl)pentanamide
SMILESCCCC(N)C(=O)N(CC)C(CC)Cc1ccccc1
InChIInChI=1S/C17H28N2O/c1-4-10-16(18)17(20)19(6-3)15(5-2)13-14-11-8-7-9-12-14/h7-9,11-12,15-16H,4-6,10,13,18H2,1-3H3
InChIKeyNJWCTXJMPALIQX-UHFFFAOYSA-N
MW276.42 g/mol
LogP2.98
Rot. Bonds8

About 2-amino-N-ethyl-N-(1-phenylbutan-2-yl)pentanamide

2-amino-N-ethyl-N-(1-phenylbutan-2-yl)pentanamide (PubChem CID 119337188) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is 2-amino-N-ethyl-N-(1-phenylbutan-2-yl)pentanamide.

Molecular Properties

Compound Name2-amino-N-ethyl-N-(1-phenylbutan-2-yl)pentanamide
PubChem CID119337188
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name2-amino-N-ethyl-N-(1-phenylbutan-2-yl)pentanamide
SMILESCCCC(N)C(=O)N(CC)C(CC)Cc1ccccc1
InChIInChI=1S/C17H28N2O/c1-4-10-16(18)17(20)19(6-3)15(5-2)13-14-11-8-7-9-12-14/h7-9,11-12,15-16H,4-6,10,13,18H2,1-3H3
InChIKeyNJWCTXJMPALIQX-UHFFFAOYSA-N
XLogP2.98
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-N-ethyl-N-(1-methoxypropan-2-yl)-3-phenylpropanamide
CID 78985414
(2S)-2-amino-N-ethyl-N-(1-methoxypropan-2-yl)-3-phenylpropanamide
CID 61163368
(2S)-2-amino-N-(2-methoxyethyl)-N-pentan-3-yl-3-phenylpropanamide
CID 61163372
2-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-phenylbutanamide
CID 103188646
2-amino-N-methyl-3-phenyl-N-propylpropanamide
CID 43271352
2-[[(2R)-2-amino-3-phenylpropanoyl]-butan-2-ylamino]acetic acid
CID 78985735
4-amino-N-ethyl-3-methoxy-N-(1-phenylbutan-2-yl)butanamide;hydrochloride
CID 120593580
2-amino-N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)pentanamide
CID 119877071
2-[2-aminopentanoyl(benzyl)amino]-2-methylpropanoic acid
CID 175596193
(2S)-2-amino-4-phenyl-N-propan-2-yl-N-propylbutanamide
CID 104983873
2-amino-N-(1-phenylpentan-2-yl)-N-propylacetamide
CID 119316989
2-amino-N-butyl-N-(1-phenylethyl)pentanamide
CID 119331563

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-N-(1-phenylbutan-2-yl)pentanamide?
The IUPAC name of 2-amino-N-ethyl-N-(1-phenylbutan-2-yl)pentanamide (CID 119337188) is 2-amino-N-ethyl-N-(1-phenylbutan-2-yl)pentanamide.
What is the SMILES notation for 2-amino-N-ethyl-N-(1-phenylbutan-2-yl)pentanamide?
The canonical SMILES for 2-amino-N-ethyl-N-(1-phenylbutan-2-yl)pentanamide is CCCC(N)C(=O)N(CC)C(CC)Cc1ccccc1.
What is the InChIKey of 2-amino-N-ethyl-N-(1-phenylbutan-2-yl)pentanamide?
The InChIKey is NJWCTXJMPALIQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-4-10-16(18)17(20)19(6-3)15(5-2)13-14-11-8-7-9-12-14/h7-9,11-12,15-16H,4-6,10,13,18H2,1-3H3.
What are the key properties of 2-amino-N-ethyl-N-(1-phenylbutan-2-yl)pentanamide?
2-amino-N-ethyl-N-(1-phenylbutan-2-yl)pentanamide has a molecular weight of 276.42 g/mol, XLogP of 2.98, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-N-(1-phenylbutan-2-yl)pentanamide is sourced from PubChem (CID 119337188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).