2-[[cyclopropyl(propyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine

C15H30N2 — CID 62615565

IUPAC2-[[cyclopropyl(propyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine
SMILESCCCN(CC1CC(C)CCC1NC)C1CC1
InChIInChI=1S/C15H30N2/c1-4-9-17(14-6-7-14)11-13-10-12(2)5-8-15(13)16-3/h12-16H,4-11H2,1-3H3
InChIKeyVIQCBWKXAVSHKQ-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.88
Rot. Bonds6

About 2-[[cyclopropyl(propyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine

2-[[cyclopropyl(propyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine (PubChem CID 62615565) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 2-[[cyclopropyl(propyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Name2-[[cyclopropyl(propyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine
PubChem CID62615565
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name2-[[cyclopropyl(propyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine
SMILESCCCN(CC1CC(C)CCC1NC)C1CC1
InChIInChI=1S/C15H30N2/c1-4-9-17(14-6-7-14)11-13-10-12(2)5-8-15(13)16-3/h12-16H,4-11H2,1-3H3
InChIKeyVIQCBWKXAVSHKQ-UHFFFAOYSA-N
XLogP2.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[cyclopropyl(3-methylbutyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine
CID 78991237
2-[[butyl(cyclopropyl)amino]methyl]-4-ethyl-N-methylcyclohexan-1-amine
CID 62610841
2-[[5-methyl-2-(methylamino)cyclohexyl]methyl-propylamino]ethanol
CID 55094802
N,4-dimethyl-2-[[methyl(pentyl)amino]methyl]cyclohexan-1-amine
CID 62615388
2-[cyclopropyl-[[2-(methylamino)-5-propylcyclohexyl]methyl]amino]ethanol
CID 55094432
2-[[ethyl(propan-2-yl)amino]methyl]-N,4-dimethylcyclohexan-1-amine
CID 62614852
2-[[cyclopropyl(propyl)amino]methyl]-4-ethyl-N-propylcyclohexan-1-amine
CID 63484004
2-[cyclobutyl-[[5-ethyl-2-(methylamino)cyclohexyl]methyl]amino]ethanol
CID 102870906
2-[[cyclopropyl(propyl)amino]methyl]-N-ethyl-4-propan-2-ylcyclohexan-1-amine
CID 63484331
2-[cyclopropyl-[[2-(methylamino)-5-propan-2-ylcyclohexyl]methyl]amino]ethanol
CID 62708874
2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine
CID 62611562
2-[[ethyl(2-ethylbutyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine
CID 63495552

Frequently Asked Questions

What is the IUPAC name of 2-[[cyclopropyl(propyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine?
The IUPAC name of 2-[[cyclopropyl(propyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine (CID 62615565) is 2-[[cyclopropyl(propyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine.
What is the SMILES notation for 2-[[cyclopropyl(propyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine?
The canonical SMILES for 2-[[cyclopropyl(propyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine is CCCN(CC1CC(C)CCC1NC)C1CC1.
What is the InChIKey of 2-[[cyclopropyl(propyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine?
The InChIKey is VIQCBWKXAVSHKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-4-9-17(14-6-7-14)11-13-10-12(2)5-8-15(13)16-3/h12-16H,4-11H2,1-3H3.
What are the key properties of 2-[[cyclopropyl(propyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine?
2-[[cyclopropyl(propyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine has a molecular weight of 238.42 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cyclopropyl(propyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine is sourced from PubChem (CID 62615565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).