2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine

C13H26N2 — CID 81171568

IUPAC2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine
SMILESCN(CCC1(CN)CCC1)CC1CCC1
InChIInChI=1S/C13H26N2/c1-15(10-12-4-2-5-12)9-8-13(11-14)6-3-7-13/h12H,2-11,14H2,1H3
InChIKeyGKUABKPAPNFZGS-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.24
Rot. Bonds6

About 2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine

2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine (PubChem CID 81171568) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine.

Molecular Properties

Compound Name2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine
PubChem CID81171568
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine
SMILESCN(CCC1(CN)CCC1)CC1CCC1
InChIInChI=1S/C13H26N2/c1-15(10-12-4-2-5-12)9-8-13(11-14)6-3-7-13/h12H,2-11,14H2,1H3
InChIKeyGKUABKPAPNFZGS-UHFFFAOYSA-N
XLogP2.24
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-(oxan-2-ylmethyl)ethanamine
CID 81171118
N-[[1-(aminomethyl)cyclopentyl]methyl]-1-cyclopentyl-N-methylmethanamine
CID 63633209
1-[2-[cyclopentylmethyl(methyl)amino]ethyl]cyclobutan-1-amine
CID 79841858
N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-methylcyclohexanamine
CID 81169270
N-[[1-(aminomethyl)cyclohexyl]methyl]-1-cyclopentyl-N-methylmethanamine
CID 63631821
1-[2-[cyclohexylmethyl(methyl)amino]ethyl]cyclobutan-1-amine
CID 79842509
N'-(cyclopentylmethyl)-N'-methylethane-1,2-diamine
CID 55151127
1-[2-[cyclobutylmethyl(methyl)amino]ethyl]-N-methylcyclohexan-1-amine
CID 65241545
N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N-methylthiolan-3-amine
CID 81168855
N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-N,2-dimethylbutan-2-amine
CID 81169937
N-[[1-(bromomethyl)cyclobutyl]methyl]-1-cyclopentyl-N-methylmethanamine
CID 65009854
N-[[1-[[cyclobutylmethyl(methyl)amino]methyl]cyclopentyl]methyl]ethanamine
CID 55125957

Frequently Asked Questions

What is the IUPAC name of 2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine?
The IUPAC name of 2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine (CID 81171568) is 2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine.
What is the SMILES notation for 2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine?
The canonical SMILES for 2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine is CN(CCC1(CN)CCC1)CC1CCC1.
What is the InChIKey of 2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine?
The InChIKey is GKUABKPAPNFZGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-15(10-12-4-2-5-12)9-8-13(11-14)6-3-7-13/h12H,2-11,14H2,1H3.
What are the key properties of 2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine?
2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine has a molecular weight of 210.36 g/mol, XLogP of 2.24, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine is sourced from PubChem (CID 81171568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).