1-(aminomethyl)-N-(3-methylcyclopentyl)cyclobutane-1-carboxamide

C12H22N2O — CID 114545052

IUPAC1-(aminomethyl)-N-(3-methylcyclopentyl)cyclobutane-1-carboxamide
SMILESCC1CCC(NC(=O)C2(CN)CCC2)C1
InChIInChI=1S/C12H22N2O/c1-9-3-4-10(7-9)14-11(15)12(8-13)5-2-6-12/h9-10H,2-8,13H2,1H3,(H,14,15)
InChIKeyLOXASNGKTHCFKB-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.42
Rot. Bonds3

About 1-(aminomethyl)-N-(3-methylcyclopentyl)cyclobutane-1-carboxamide

1-(aminomethyl)-N-(3-methylcyclopentyl)cyclobutane-1-carboxamide (PubChem CID 114545052) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(3-methylcyclopentyl)cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-(3-methylcyclopentyl)cyclobutane-1-carboxamide
PubChem CID114545052
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name1-(aminomethyl)-N-(3-methylcyclopentyl)cyclobutane-1-carboxamide
SMILESCC1CCC(NC(=O)C2(CN)CCC2)C1
InChIInChI=1S/C12H22N2O/c1-9-3-4-10(7-9)14-11(15)12(8-13)5-2-6-12/h9-10H,2-8,13H2,1H3,(H,14,15)
InChIKeyLOXASNGKTHCFKB-UHFFFAOYSA-N
XLogP1.42
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(aminomethyl)-N-(3,5-dimethylcyclohexyl)cycloheptane-1-carboxamide
CID 64732102
1-(aminomethyl)-N-(2,4-dimethylcyclohexyl)cyclohexane-1-carboxamide
CID 63996093
1-(aminomethyl)-N-(3-methylsulfanylcyclopentyl)cyclohexane-1-carboxamide
CID 114123111
1-(aminomethyl)-N-(4-hydroxycyclohexyl)-4-methylcyclohexane-1-carboxamide
CID 104966706
N-(4-aminocyclohexyl)-1-(aminomethyl)-4-methylcyclohexane-1-carboxamide
CID 115442068
1-(aminomethyl)-N-(oxan-4-yl)cyclobutane-1-carboxamide
CID 80588748
1-(aminomethyl)-N-(3-hydroxycyclohexyl)cycloheptane-1-carboxamide
CID 115443799
1-(aminomethyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]cyclobutane-1-carboxamide
CID 115447469
1-(aminomethyl)-N-[(3-methylcyclopentyl)methyl]cycloheptane-1-carboxamide
CID 107412357
1-(aminomethyl)-N-(4-propan-2-ylcyclohexyl)cyclopropane-1-carboxamide
CID 71234398
2-amino-N-(3-methylcyclopentyl)acetamide
CID 114546114
1-(aminomethyl)-N-[4-(trifluoromethyl)cyclohexyl]cyclohexane-1-carboxamide
CID 115437435

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(3-methylcyclopentyl)cyclobutane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-(3-methylcyclopentyl)cyclobutane-1-carboxamide (CID 114545052) is 1-(aminomethyl)-N-(3-methylcyclopentyl)cyclobutane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-(3-methylcyclopentyl)cyclobutane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-(3-methylcyclopentyl)cyclobutane-1-carboxamide is CC1CCC(NC(=O)C2(CN)CCC2)C1.
What is the InChIKey of 1-(aminomethyl)-N-(3-methylcyclopentyl)cyclobutane-1-carboxamide?
The InChIKey is LOXASNGKTHCFKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-9-3-4-10(7-9)14-11(15)12(8-13)5-2-6-12/h9-10H,2-8,13H2,1H3,(H,14,15).
What are the key properties of 1-(aminomethyl)-N-(3-methylcyclopentyl)cyclobutane-1-carboxamide?
1-(aminomethyl)-N-(3-methylcyclopentyl)cyclobutane-1-carboxamide has a molecular weight of 210.32 g/mol, XLogP of 1.42, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(3-methylcyclopentyl)cyclobutane-1-carboxamide is sourced from PubChem (CID 114545052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).