N-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride

C15H31ClN2O — CID 119602350

IUPACN-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride
SMILESCCCCC(CC)CC(=O)NC1CCCC1CN.Cl
InChIInChI=1S/C15H30N2O.ClH/c1-3-5-7-12(4-2)10-15(18)17-14-9-6-8-13(14)11-16;/h12-14H,3-11,16H2,1-2H3,(H,17,18);1H
InChIKeyHLTWLBONXXLLMW-UHFFFAOYSA-N
MW290.88 g/mol
LogP3.26
Rot. Bonds8

About N-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride

N-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride (PubChem CID 119602350) has the molecular formula C15H31ClN2O and a molecular weight of 290.88 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride
PubChem CID119602350
Molecular FormulaC15H31ClN2O
Molecular Weight290.88 g/mol
Exact Mass290.21
IUPAC NameN-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride
SMILESCCCCC(CC)CC(=O)NC1CCCC1CN.Cl
InChIInChI=1S/C15H30N2O.ClH/c1-3-5-7-12(4-2)10-15(18)17-14-9-6-8-13(14)11-16;/h12-14H,3-11,16H2,1-2H3,(H,17,18);1H
InChIKeyHLTWLBONXXLLMW-UHFFFAOYSA-N
XLogP3.26
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.88
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(aminomethyl)cyclopentyl]pentanamide
CID 62957090
3-(aminomethyl)-N-(2-ethylcyclohexyl)pentanamide
CID 81076013
N-[2-(aminomethyl)cyclopentyl]-2-pentylsulfonylacetamide;hydrochloride
CID 119601555
N-[2-(aminomethyl)cyclopentyl]-3-phenylpentanamide;hydrochloride
CID 119604654
N'-[2-(aminomethyl)cyclopentyl]-N-propylbutanediamide;hydrochloride
CID 119604127
N-[2-(aminomethyl)cyclopentyl]-4-(dipropylamino)butanamide;dihydrochloride
CID 119602223
N-[4-[[2-(aminomethyl)cyclopentyl]amino]-4-oxobutan-2-yl]cyclopentanecarboxamide
CID 119604609
N-[2-(aminomethyl)cyclopentyl]-2-(4-butylphenyl)acetamide
CID 119604897
N-[2-(aminomethyl)cyclohexyl]-2-methylbutanamide;hydrochloride
CID 119609146
2-[3-(aminomethyl)pentanoylamino]cyclopentane-1-carboxylic acid
CID 81079851
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-ethylheptanamide;hydrochloride
CID 119456810
2-acetamido-N-[2-(aminomethyl)cyclohexyl]acetamide;hydrochloride
CID 119610509

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride (CID 119602350) is N-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride is CCCCC(CC)CC(=O)NC1CCCC1CN.Cl.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride?
The InChIKey is HLTWLBONXXLLMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O.ClH/c1-3-5-7-12(4-2)10-15(18)17-14-9-6-8-13(14)11-16;/h12-14H,3-11,16H2,1-2H3,(H,17,18);1H.
What are the key properties of N-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride?
N-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride has a molecular weight of 290.88 g/mol, XLogP of 3.26, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride is sourced from PubChem (CID 119602350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).