1-(aminomethyl)-N,2-dimethyl-N-(3-methylbutyl)cyclopentan-1-amine

C13H28N2 — CID 65045881

IUPAC1-(aminomethyl)-N,2-dimethyl-N-(3-methylbutyl)cyclopentan-1-amine
SMILESCC(C)CCN(C)C1(CN)CCCC1C
InChIInChI=1S/C13H28N2/c1-11(2)7-9-15(4)13(10-14)8-5-6-12(13)3/h11-12H,5-10,14H2,1-4H3
InChIKeyWDAUXTRPPWRKMZ-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.48
Rot. Bonds5

About 1-(aminomethyl)-N,2-dimethyl-N-(3-methylbutyl)cyclopentan-1-amine

1-(aminomethyl)-N,2-dimethyl-N-(3-methylbutyl)cyclopentan-1-amine (PubChem CID 65045881) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 1-(aminomethyl)-N,2-dimethyl-N-(3-methylbutyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-N,2-dimethyl-N-(3-methylbutyl)cyclopentan-1-amine
PubChem CID65045881
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name1-(aminomethyl)-N,2-dimethyl-N-(3-methylbutyl)cyclopentan-1-amine
SMILESCC(C)CCN(C)C1(CN)CCCC1C
InChIInChI=1S/C13H28N2/c1-11(2)7-9-15(4)13(10-14)8-5-6-12(13)3/h11-12H,5-10,14H2,1-4H3
InChIKeyWDAUXTRPPWRKMZ-UHFFFAOYSA-N
XLogP2.48
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(aminomethyl)-N,2-dimethyl-N-propylcyclopentan-1-amine
CID 65045561
N'-[1-(aminomethyl)-2-methylcyclopentyl]-N,N,N'-trimethylethane-1,2-diamine
CID 65045165
1-(aminomethyl)-N-(2-ethoxyethyl)-N,2-dimethylcyclopentan-1-amine
CID 81059701
1-(aminomethyl)-N-(3-methoxypropyl)-N,2-dimethylcyclopentan-1-amine
CID 65045108
1-(aminomethyl)-N,2-dimethyl-N-(2-pyrrolidin-1-ylethyl)cyclopentan-1-amine
CID 65044747
1-(aminomethyl)-N-butan-2-yl-N,2-dimethylcyclopentan-1-amine
CID 65045613
1-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N,2-dimethylcyclopentan-1-amine
CID 65045048
1-(aminomethyl)-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclopentan-1-amine
CID 65045429
1-(aminomethyl)-N-methyl-N-(3-methylbutyl)cyclopentan-1-amine
CID 61426013
1-(aminomethyl)-N,2-dimethyl-N-(oxan-3-ylmethyl)cyclohexan-1-amine
CID 63725587
2-N-[1-(aminomethyl)-2-methylcyclohexyl]-2-N-ethyl-1-N,1-N-dimethylpropane-1,2-diamine
CID 103188091
1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine
CID 65044842

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N,2-dimethyl-N-(3-methylbutyl)cyclopentan-1-amine?
The IUPAC name of 1-(aminomethyl)-N,2-dimethyl-N-(3-methylbutyl)cyclopentan-1-amine (CID 65045881) is 1-(aminomethyl)-N,2-dimethyl-N-(3-methylbutyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-N,2-dimethyl-N-(3-methylbutyl)cyclopentan-1-amine?
The canonical SMILES for 1-(aminomethyl)-N,2-dimethyl-N-(3-methylbutyl)cyclopentan-1-amine is CC(C)CCN(C)C1(CN)CCCC1C.
What is the InChIKey of 1-(aminomethyl)-N,2-dimethyl-N-(3-methylbutyl)cyclopentan-1-amine?
The InChIKey is WDAUXTRPPWRKMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-11(2)7-9-15(4)13(10-14)8-5-6-12(13)3/h11-12H,5-10,14H2,1-4H3.
What are the key properties of 1-(aminomethyl)-N,2-dimethyl-N-(3-methylbutyl)cyclopentan-1-amine?
1-(aminomethyl)-N,2-dimethyl-N-(3-methylbutyl)cyclopentan-1-amine has a molecular weight of 212.38 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N,2-dimethyl-N-(3-methylbutyl)cyclopentan-1-amine is sourced from PubChem (CID 65045881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).