1-(aminomethyl)-N-(3-hydroxybutyl)cyclopentane-1-carboxamide

C11H22N2O2 — CID 81489303

IUPAC1-(aminomethyl)-N-(3-hydroxybutyl)cyclopentane-1-carboxamide
SMILESCC(O)CCNC(=O)C1(CN)CCCC1
InChIInChI=1S/C11H22N2O2/c1-9(14)4-7-13-10(15)11(8-12)5-2-3-6-11/h9,14H,2-8,12H2,1H3,(H,13,15)
InChIKeyPYYTUZTWSHKETJ-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.39
Rot. Bonds5

About 1-(aminomethyl)-N-(3-hydroxybutyl)cyclopentane-1-carboxamide

1-(aminomethyl)-N-(3-hydroxybutyl)cyclopentane-1-carboxamide (PubChem CID 81489303) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(3-hydroxybutyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-(3-hydroxybutyl)cyclopentane-1-carboxamide
PubChem CID81489303
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name1-(aminomethyl)-N-(3-hydroxybutyl)cyclopentane-1-carboxamide
SMILESCC(O)CCNC(=O)C1(CN)CCCC1
InChIInChI=1S/C11H22N2O2/c1-9(14)4-7-13-10(15)11(8-12)5-2-3-6-11/h9,14H,2-8,12H2,1H3,(H,13,15)
InChIKeyPYYTUZTWSHKETJ-UHFFFAOYSA-N
XLogP0.39
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-(aminomethyl)-N-(3-hydroxybutyl)-4-methylcyclohexane-1-carboxamide
CID 113310530
1-(aminomethyl)-N-[(2S)-2-hydroxypropyl]cyclohexane-1-carboxamide
CID 107221086
1-(aminomethyl)-N-(7-methyloctyl)cyclohexane-1-carboxamide
CID 115437743
1-(aminomethyl)-N-[2-(2-methylpropanoylamino)ethyl]cyclobutane-1-carboxamide
CID 115448338
5-[[1-(aminomethyl)cyclohexanecarbonyl]amino]-2-methylpentanoic acid
CID 104685703
1-(aminomethyl)-N-(2-hydroxypentyl)cyclopentane-1-carboxamide
CID 115739396
1-(aminomethyl)-N-[3-[methyl(propan-2-yl)amino]propyl]cyclopentane-1-carboxamide
CID 114140196
N-(3-hydroxybutyl)-3-propylpiperidine-3-carboxamide
CID 64913722
1-(aminomethyl)-N-(2-hydroxy-4-methylpentyl)cycloheptane-1-carboxamide
CID 107152969
1-(aminomethyl)-N-(4-propan-2-yloxybutyl)cyclohexane-1-carboxamide
CID 106011493
N-(3-aminobutyl)-1-ethylcyclopentane-1-carboxamide;hydrochloride
CID 119497906
1-(aminomethyl)-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide
CID 55037810

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(3-hydroxybutyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-(3-hydroxybutyl)cyclopentane-1-carboxamide (CID 81489303) is 1-(aminomethyl)-N-(3-hydroxybutyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-(3-hydroxybutyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-(3-hydroxybutyl)cyclopentane-1-carboxamide is CC(O)CCNC(=O)C1(CN)CCCC1.
What is the InChIKey of 1-(aminomethyl)-N-(3-hydroxybutyl)cyclopentane-1-carboxamide?
The InChIKey is PYYTUZTWSHKETJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-9(14)4-7-13-10(15)11(8-12)5-2-3-6-11/h9,14H,2-8,12H2,1H3,(H,13,15).
What are the key properties of 1-(aminomethyl)-N-(3-hydroxybutyl)cyclopentane-1-carboxamide?
1-(aminomethyl)-N-(3-hydroxybutyl)cyclopentane-1-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 0.39, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(3-hydroxybutyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 81489303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).