N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine

C15H30N2 — CID 114547350

IUPACN-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine
SMILESCC1CCC(CN)(CNC2CCC(C)C2)CC1
InChIInChI=1S/C15H30N2/c1-12-5-7-15(10-16,8-6-12)11-17-14-4-3-13(2)9-14/h12-14,17H,3-11,16H2,1-2H3
InChIKeyGPOSQMVLLIXHDT-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.92
Rot. Bonds4

About N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine

N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine (PubChem CID 114547350) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine
PubChem CID114547350
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC NameN-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine
SMILESCC1CCC(CN)(CNC2CCC(C)C2)CC1
InChIInChI=1S/C15H30N2/c1-12-5-7-15(10-16,8-6-12)11-17-14-4-3-13(2)9-14/h12-14,17H,3-11,16H2,1-2H3
InChIKeyGPOSQMVLLIXHDT-UHFFFAOYSA-N
XLogP2.92
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]cyclobutanamine
CID 115442724
[4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine
CID 115442703
N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-3-methylcyclopentan-1-amine
CID 114547242
N-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine
CID 130747190
1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol
CID 65107657
N'-hydroxy-2-[1-[[(4-methylcyclohexyl)amino]methyl]cyclopropyl]ethanimidamide
CID 77071817
N-[(1-ethylcyclopropyl)methyl]-3-methylcyclohexan-1-amine;hydrochloride
CID 115680355
N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-1-(trifluoromethyl)cyclopropan-1-amine
CID 106219112
3-methyl-N-[(3-methylazetidin-3-yl)methyl]cyclopentan-1-amine
CID 130871122
N-[[1-(aminomethyl)cyclopropyl]methyl]-3,3-dimethylcyclopentan-1-amine
CID 114547571
N-[1-(aminomethyl)cyclobutyl]-3-methylcyclopentan-1-amine
CID 114544710
[(1S)-1-ethyl-3-methylcyclopentyl]methanamine
CID 142068635

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine?
The IUPAC name of N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine (CID 114547350) is N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine.
What is the SMILES notation for N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine?
The canonical SMILES for N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine is CC1CCC(CN)(CNC2CCC(C)C2)CC1.
What is the InChIKey of N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine?
The InChIKey is GPOSQMVLLIXHDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-12-5-7-15(10-16,8-6-12)11-17-14-4-3-13(2)9-14/h12-14,17H,3-11,16H2,1-2H3.
What are the key properties of N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine?
N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine has a molecular weight of 238.42 g/mol, XLogP of 2.92, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine is sourced from PubChem (CID 114547350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).