4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]cyclohexan-1-amine

C15H31N3 — CID 105421357

IUPAC4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]cyclohexan-1-amine
SMILESCN(CC1CCC(N)CC1)CC1(N(C)C)CCC1
InChIInChI=1S/C15H31N3/c1-17(2)15(9-4-10-15)12-18(3)11-13-5-7-14(16)8-6-13/h13-14H,4-12,16H2,1-3H3
InChIKeyGGUXDTJKAKFXTA-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.92
Rot. Bonds5

About 4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]cyclohexan-1-amine

4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]cyclohexan-1-amine (PubChem CID 105421357) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]cyclohexan-1-amine
PubChem CID105421357
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]cyclohexan-1-amine
SMILESCN(CC1CCC(N)CC1)CC1(N(C)C)CCC1
InChIInChI=1S/C15H31N3/c1-17(2)15(9-4-10-15)12-18(3)11-13-5-7-14(16)8-6-13/h13-14H,4-12,16H2,1-3H3
InChIKeyGGUXDTJKAKFXTA-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

Analyze 4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]cyclohexan-1-amine with MolForge

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Related Compounds

4-[[cyclopropylmethyl(methyl)amino]methyl]cyclohexan-1-amine
CID 60984087
[1-[[(4-aminocyclohexyl)methyl-methylamino]methyl]cyclopentyl]methanol
CID 56741237
2-[[cyclobutylmethyl(methyl)amino]methyl]-2-methylcyclopentan-1-amine
CID 82768295
2-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]-N-propylcyclohexan-1-amine
CID 105417254
1-[[(4-ethylpiperidin-2-yl)methyl-methylamino]methyl]-N,N-dimethylcyclobutan-1-amine
CID 105421244
N-[[1-[[cyclopropylmethyl(methyl)amino]methyl]cyclopentyl]methyl]propan-1-amine
CID 62256716
N'-[[1-(dimethylamino)cyclobutyl]methyl]-N',2-dimethylpropane-1,3-diamine
CID 105413759
N-[[1-[[cyclopropylmethyl(methyl)amino]methyl]cyclohexyl]methyl]propan-1-amine
CID 62258105
[1-[[cyclopropylmethyl(methyl)amino]methyl]cyclohexyl]methanol
CID 62272579
N-[[1-(bromomethyl)cyclobutyl]methyl]-1-cyclopentyl-N-methylmethanamine
CID 65009854
N-[[1-(aminomethyl)cyclopentyl]methyl]-1-cyclopentyl-N-methylmethanamine
CID 63633209
N-[[1-(bromomethyl)cyclopropyl]methyl]-1-cyclopropyl-N-methylmethanamine
CID 65013492

Frequently Asked Questions

What is the IUPAC name of 4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]cyclohexan-1-amine?
The IUPAC name of 4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]cyclohexan-1-amine (CID 105421357) is 4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]cyclohexan-1-amine.
What is the SMILES notation for 4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]cyclohexan-1-amine?
The canonical SMILES for 4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]cyclohexan-1-amine is CN(CC1CCC(N)CC1)CC1(N(C)C)CCC1.
What is the InChIKey of 4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]cyclohexan-1-amine?
The InChIKey is GGUXDTJKAKFXTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-17(2)15(9-4-10-15)12-18(3)11-13-5-7-14(16)8-6-13/h13-14H,4-12,16H2,1-3H3.
What are the key properties of 4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]cyclohexan-1-amine?
4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]cyclohexan-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 4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 105421357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).