2-amino-N-[2-(4-ethylphenyl)propan-2-yl]pentanamide

C16H26N2O — CID 119337742

IUPAC2-amino-N-[2-(4-ethylphenyl)propan-2-yl]pentanamide
SMILESCCCC(N)C(=O)NC(C)(C)c1ccc(CC)cc1
InChIInChI=1S/C16H26N2O/c1-5-7-14(17)15(19)18-16(3,4)13-10-8-12(6-2)9-11-13/h8-11,14H,5-7,17H2,1-4H3,(H,18,19)
InChIKeyWELAXZSYFLXVEF-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.73
Rot. Bonds6

About 2-amino-N-[2-(4-ethylphenyl)propan-2-yl]pentanamide

2-amino-N-[2-(4-ethylphenyl)propan-2-yl]pentanamide (PubChem CID 119337742) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-amino-N-[2-(4-ethylphenyl)propan-2-yl]pentanamide.

Molecular Properties

Compound Name2-amino-N-[2-(4-ethylphenyl)propan-2-yl]pentanamide
PubChem CID119337742
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2-amino-N-[2-(4-ethylphenyl)propan-2-yl]pentanamide
SMILESCCCC(N)C(=O)NC(C)(C)c1ccc(CC)cc1
InChIInChI=1S/C16H26N2O/c1-5-7-14(17)15(19)18-16(3,4)13-10-8-12(6-2)9-11-13/h8-11,14H,5-7,17H2,1-4H3,(H,18,19)
InChIKeyWELAXZSYFLXVEF-UHFFFAOYSA-N
XLogP2.73
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-N-[2-(4-bromophenyl)propan-2-yl]pentanamide
CID 113264007
(2S)-2-amino-N-[2-(4-ethylphenyl)propan-2-yl]propanamide
CID 119337733
2-amino-N-[2-(3-chlorophenyl)propan-2-yl]pentanamide
CID 119330329
2-amino-N-[1-(4-bromophenyl)-2-methylpropan-2-yl]pentanamide;hydrochloride
CID 119317253
4-amino-5-[2-(4-bromophenyl)propan-2-ylamino]-5-oxopentanoic acid
CID 64896765
3-amino-4-[2-(4-bromophenyl)propan-2-ylamino]-4-oxobutanoic acid
CID 64896073
2-[[(2S)-2-aminopentanoyl]amino]-2-phenylpropanoic acid
CID 103870869
(2S)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)pentanamide
CID 107570839
(2R)-2-amino-4-methylsulfanyl-N-(2-phenylpropan-2-yl)butanamide
CID 114264096
2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)pentanamide
CID 105058238
(2S)-2-amino-N-(3-methylpentan-3-yl)pentanamide
CID 106328652
(2R)-2-amino-N-(2-methylbutan-2-yl)pentanamide
CID 103793847

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(4-ethylphenyl)propan-2-yl]pentanamide?
The IUPAC name of 2-amino-N-[2-(4-ethylphenyl)propan-2-yl]pentanamide (CID 119337742) is 2-amino-N-[2-(4-ethylphenyl)propan-2-yl]pentanamide.
What is the SMILES notation for 2-amino-N-[2-(4-ethylphenyl)propan-2-yl]pentanamide?
The canonical SMILES for 2-amino-N-[2-(4-ethylphenyl)propan-2-yl]pentanamide is CCCC(N)C(=O)NC(C)(C)c1ccc(CC)cc1.
What is the InChIKey of 2-amino-N-[2-(4-ethylphenyl)propan-2-yl]pentanamide?
The InChIKey is WELAXZSYFLXVEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-5-7-14(17)15(19)18-16(3,4)13-10-8-12(6-2)9-11-13/h8-11,14H,5-7,17H2,1-4H3,(H,18,19).
What are the key properties of 2-amino-N-[2-(4-ethylphenyl)propan-2-yl]pentanamide?
2-amino-N-[2-(4-ethylphenyl)propan-2-yl]pentanamide has a molecular weight of 262.40 g/mol, XLogP of 2.73, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(4-ethylphenyl)propan-2-yl]pentanamide is sourced from PubChem (CID 119337742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).