3-amino-N-phenylpentanamide

C11H16N2O — CID 79006475

IUPAC3-amino-N-phenylpentanamide
SMILESCCC(N)CC(=O)Nc1ccccc1
InChIInChI=1S/C11H16N2O/c1-2-9(12)8-11(14)13-10-6-4-3-5-7-10/h3-7,9H,2,8,12H2,1H3,(H,13,14)
InChIKeyQPAVGVQVUPXCQK-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.75
Rot. Bonds4

About 3-amino-N-phenylpentanamide

3-amino-N-phenylpentanamide (PubChem CID 79006475) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 3-amino-N-phenylpentanamide.

Molecular Properties

Compound Name3-amino-N-phenylpentanamide
PubChem CID79006475
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name3-amino-N-phenylpentanamide
SMILESCCC(N)CC(=O)Nc1ccccc1
InChIInChI=1S/C11H16N2O/c1-2-9(12)8-11(14)13-10-6-4-3-5-7-10/h3-7,9H,2,8,12H2,1H3,(H,13,14)
InChIKeyQPAVGVQVUPXCQK-UHFFFAOYSA-N
XLogP1.75
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-aminobutylsulfinyl)-N-phenylacetamide
CID 81193786
3-methyl-N-[4-(phenylcarbamoylamino)phenyl]butanamide
CID 17193970
(3S)-3,4-dimethyl-N-phenylpentanamide
CID 102017324
(3R)-3-chloro-N-phenylbutanamide
CID 94188827
3-amino-N-(4-bromo-3,5-dimethylphenyl)pentanamide
CID 107574314
4-(3-aminopentanoylamino)-2-methoxybenzoic acid
CID 107208106
3-amino-N-(4-phenylphenyl)butanamide
CID 60835996
3-amino-N-phenyl-4-(2,4,5-trifluorophenyl)butanamide
CID 169187552
3-(2-methylbutylamino)-N-phenylbutanamide
CID 114244260
3-amino-N-(4-anilinophenyl)-3-phenylpropanamide
CID 57278352
(3S)-3-amino-3-(4-methoxyphenyl)-N-phenylpropanamide
CID 101486990
4-amino-N-phenyldodecanamide
CID 154099763

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-phenylpentanamide?
The IUPAC name of 3-amino-N-phenylpentanamide (CID 79006475) is 3-amino-N-phenylpentanamide.
What is the SMILES notation for 3-amino-N-phenylpentanamide?
The canonical SMILES for 3-amino-N-phenylpentanamide is CCC(N)CC(=O)Nc1ccccc1.
What is the InChIKey of 3-amino-N-phenylpentanamide?
The InChIKey is QPAVGVQVUPXCQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-2-9(12)8-11(14)13-10-6-4-3-5-7-10/h3-7,9H,2,8,12H2,1H3,(H,13,14).
What are the key properties of 3-amino-N-phenylpentanamide?
3-amino-N-phenylpentanamide has a molecular weight of 192.26 g/mol, XLogP of 1.75, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-phenylpentanamide is sourced from PubChem (CID 79006475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).