2-amino-N-(3-cyclohexylbutan-2-yl)pentanamide

C15H30N2O — CID 119338034

IUPAC2-amino-N-(3-cyclohexylbutan-2-yl)pentanamide
SMILESCCCC(N)C(=O)NC(C)C(C)C1CCCCC1
InChIInChI=1S/C15H30N2O/c1-4-8-14(16)15(18)17-12(3)11(2)13-9-6-5-7-10-13/h11-14H,4-10,16H2,1-3H3,(H,17,18)
InChIKeyMTYZBAPVZRGUBV-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.83
Rot. Bonds6

About 2-amino-N-(3-cyclohexylbutan-2-yl)pentanamide

2-amino-N-(3-cyclohexylbutan-2-yl)pentanamide (PubChem CID 119338034) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-amino-N-(3-cyclohexylbutan-2-yl)pentanamide.

Molecular Properties

Compound Name2-amino-N-(3-cyclohexylbutan-2-yl)pentanamide
PubChem CID119338034
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-amino-N-(3-cyclohexylbutan-2-yl)pentanamide
SMILESCCCC(N)C(=O)NC(C)C(C)C1CCCCC1
InChIInChI=1S/C15H30N2O/c1-4-8-14(16)15(18)17-12(3)11(2)13-9-6-5-7-10-13/h11-14H,4-10,16H2,1-3H3,(H,17,18)
InChIKeyMTYZBAPVZRGUBV-UHFFFAOYSA-N
XLogP2.83
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-(3-cyclohexylbutan-2-yl)propanamide
CID 119338014
3-amino-N-(3-cyclohexylbutan-2-yl)-2-methylbutanamide
CID 120501833
2-amino-N-(3-methylbutan-2-yl)pentanamide
CID 43650228
(2S)-2-amino-N-(3-cyclohexylbutan-2-yl)-3,3-dimethylbutanamide;hydrochloride
CID 119809042
2-amino-N-(4-propan-2-ylcyclohexyl)pentanamide
CID 119339852
(2R)-2-amino-N-(2-propan-2-ylcyclohexyl)pentanamide
CID 103796389
3-[[(2S)-2-aminopentanoyl]amino]-3-cyclopropylpropanoic acid
CID 103870481
2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]pentanamide;dihydrochloride
CID 119850478
(2S)-2-amino-N-cycloheptylhexanamide
CID 103830902
3-amino-4-[[(1S)-1-cyclohexylethyl]amino]-4-oxobutanoic acid
CID 81386150
(2S)-2-amino-N-(2-methylcycloheptyl)pentanamide
CID 107569955
(2R)-2-amino-N-[(1R)-1-cyclohexylethyl]-4-methylsulfanylbutanamide
CID 104908828

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-cyclohexylbutan-2-yl)pentanamide?
The IUPAC name of 2-amino-N-(3-cyclohexylbutan-2-yl)pentanamide (CID 119338034) is 2-amino-N-(3-cyclohexylbutan-2-yl)pentanamide.
What is the SMILES notation for 2-amino-N-(3-cyclohexylbutan-2-yl)pentanamide?
The canonical SMILES for 2-amino-N-(3-cyclohexylbutan-2-yl)pentanamide is CCCC(N)C(=O)NC(C)C(C)C1CCCCC1.
What is the InChIKey of 2-amino-N-(3-cyclohexylbutan-2-yl)pentanamide?
The InChIKey is MTYZBAPVZRGUBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-4-8-14(16)15(18)17-12(3)11(2)13-9-6-5-7-10-13/h11-14H,4-10,16H2,1-3H3,(H,17,18).
What are the key properties of 2-amino-N-(3-cyclohexylbutan-2-yl)pentanamide?
2-amino-N-(3-cyclohexylbutan-2-yl)pentanamide has a molecular weight of 254.42 g/mol, XLogP of 2.83, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-cyclohexylbutan-2-yl)pentanamide is sourced from PubChem (CID 119338034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).