1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethylcyclopentan-1-amine

C15H31N3 — CID 105413972

IUPAC1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethylcyclopentan-1-amine
SMILESCC1CCC(CN)(N(C)CC2(N(C)C)CCC2)C1
InChIInChI=1S/C15H31N3/c1-13-6-9-15(10-13,11-16)18(4)12-14(17(2)3)7-5-8-14/h13H,5-12,16H2,1-4H3
InChIKeyXUOGUTCBILJZPW-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.92
Rot. Bonds5

About 1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethylcyclopentan-1-amine

1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethylcyclopentan-1-amine (PubChem CID 105413972) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethylcyclopentan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethylcyclopentan-1-amine
PubChem CID105413972
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethylcyclopentan-1-amine
SMILESCC1CCC(CN)(N(C)CC2(N(C)C)CCC2)C1
InChIInChI=1S/C15H31N3/c1-13-6-9-15(10-13,11-16)18(4)12-14(17(2)3)7-5-8-14/h13H,5-12,16H2,1-4H3
InChIKeyXUOGUTCBILJZPW-UHFFFAOYSA-N
XLogP1.92
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3,5-trimethylcyclohexan-1-amine
CID 105413969
1-(aminomethyl)-N,N,4-trimethylcycloheptan-1-amine
CID 65085240
1-(aminomethyl)-N,N,4-trimethylcyclohexan-1-amine
CID 9161377
1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,2,4-trimethylcyclohexan-1-amine
CID 105414063
N-[1-(aminomethyl)-3-methylcyclopentyl]-N-methylcyclohexanamine
CID 64501146
1-(aminomethyl)-N-(2-ethoxyethyl)-N,3-dimethylcyclopentan-1-amine
CID 81059702
1-(aminomethyl)-N-(2,2-difluoroethyl)-N,3-dimethylcyclohexan-1-amine
CID 62007114
4-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyloxepan-4-amine
CID 105414221
1-(aminomethyl)-N-benzyl-N,3-dimethylcyclohexan-1-amine
CID 43176319
1-(aminomethyl)-N,3-dimethyl-N-(oxan-4-ylmethyl)cyclopentan-1-amine
CID 64500110
1-(aminomethyl)-N,3-dimethyl-N-[(2-methylphenyl)methyl]cyclopentan-1-amine
CID 64501771
N-[1-(aminomethyl)-3-methylcyclopentyl]-N,3-dimethylcyclohexan-1-amine
CID 64502176

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethylcyclopentan-1-amine?
The IUPAC name of 1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethylcyclopentan-1-amine (CID 105413972) is 1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethylcyclopentan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethylcyclopentan-1-amine?
The canonical SMILES for 1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethylcyclopentan-1-amine is CC1CCC(CN)(N(C)CC2(N(C)C)CCC2)C1.
What is the InChIKey of 1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethylcyclopentan-1-amine?
The InChIKey is XUOGUTCBILJZPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-13-6-9-15(10-13,11-16)18(4)12-14(17(2)3)7-5-8-14/h13H,5-12,16H2,1-4H3.
What are the key properties of 1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethylcyclopentan-1-amine?
1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethylcyclopentan-1-amine has a molecular weight of 253.43 g/mol, XLogP of 1.92, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethylcyclopentan-1-amine is sourced from PubChem (CID 105413972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).