4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride

C14H29ClN2O — CID 120560365

IUPAC4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride
SMILESCC(N)CCC(=O)NCCCC1CCCCC1.Cl
InChIInChI=1S/C14H28N2O.ClH/c1-12(15)9-10-14(17)16-11-5-8-13-6-3-2-4-7-13;/h12-13H,2-11,15H2,1H3,(H,16,17);1H
InChIKeyYTFFLKTXEPEWML-UHFFFAOYSA-N
MW276.85 g/mol
LogP3.01
Rot. Bonds7

About 4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride

4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride (PubChem CID 120560365) has the molecular formula C14H29ClN2O and a molecular weight of 276.85 g/mol. Its IUPAC name is 4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride.

Molecular Properties

Compound Name4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride
PubChem CID120560365
Molecular FormulaC14H29ClN2O
Molecular Weight276.85 g/mol
Exact Mass276.20
IUPAC Name4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride
SMILESCC(N)CCC(=O)NCCCC1CCCCC1.Cl
InChIInChI=1S/C14H28N2O.ClH/c1-12(15)9-10-14(17)16-11-5-8-13-6-3-2-4-7-13;/h12-13H,2-11,15H2,1H3,(H,16,17);1H
InChIKeyYTFFLKTXEPEWML-UHFFFAOYSA-N
XLogP3.01
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.85
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-amino-N-(2-cyclopentylethyl)hexanamide
CID 82852565
4-(2-aminoethyl)-N-(3-cyclopentylpropyl)-5-methylhexanamide
CID 106011723
(2S)-2-amino-N-(3-cyclopentylpropyl)propanamide
CID 103795255
4-amino-N-(4-cyclohexylbutan-2-yl)pentanamide
CID 120562906
3-amino-N-(2-cyclohexylethyl)butanamide;hydrochloride
CID 119725742
4-(3-cyclodecylpropylamino)-4-oxobutanoic acid
CID 146506489
3-amino-N-(3-cyclopropylpropyl)butanamide
CID 115740565
3-cyclohexyl-N-(5-hydroxy-4-methylpentyl)propanamide
CID 113340801
N-(4-chloropentyl)-3-cyclopentylpropanamide
CID 106129653
(2S)-2-amino-N-(3-cyclopentylpropyl)-4-methylpentanamide;hydrochloride
CID 119724237
2-amino-N-(3-cyclohexylpropyl)-3-methylpentanamide
CID 119724279
N-(3-aminopropyl)-4-cyclopentylbutanamide
CID 119409090

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride?
The IUPAC name of 4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride (CID 120560365) is 4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride.
What is the SMILES notation for 4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride?
The canonical SMILES for 4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride is CC(N)CCC(=O)NCCCC1CCCCC1.Cl.
What is the InChIKey of 4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride?
The InChIKey is YTFFLKTXEPEWML-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O.ClH/c1-12(15)9-10-14(17)16-11-5-8-13-6-3-2-4-7-13;/h12-13H,2-11,15H2,1H3,(H,16,17);1H.
What are the key properties of 4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride?
4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride has a molecular weight of 276.85 g/mol, XLogP of 3.01, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride is sourced from PubChem (CID 120560365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).