[4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine

C10H22N2 — CID 115442703

IUPAC[4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine
SMILESCNCC1(CN)CCC(C)CC1
InChIInChI=1S/C10H22N2/c1-9-3-5-10(7-11,6-4-9)8-12-2/h9,12H,3-8,11H2,1-2H3
InChIKeyIOHDOVUBZXASEN-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.36
Rot. Bonds3

About [4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine

[4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine (PubChem CID 115442703) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is [4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine
PubChem CID115442703
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name[4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine
SMILESCNCC1(CN)CCC(C)CC1
InChIInChI=1S/C10H22N2/c1-9-3-5-10(7-11,6-4-9)8-12-2/h9,12H,3-8,11H2,1-2H3
InChIKeyIOHDOVUBZXASEN-UHFFFAOYSA-N
XLogP1.36
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]cyclobutanamine
CID 115442724
N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine
CID 114547350
N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-1-(trifluoromethyl)cyclopropan-1-amine
CID 106219112
ethane;1-(1-ethyl-3-methylcyclopentyl)-N-methylmethanamine
CID 144836512
N-methyl-1-(3-methyl-1-propylcyclopentyl)methanamine
CID 170362214
(4-methyl-1-prop-2-ynylcyclohexyl)methanamine
CID 126977400
[(1S)-1-ethyl-3-methylcyclopentyl]methanamine
CID 142068635
[1-(3,3-dimethylbutyl)-4-methylcyclohexyl]methanamine
CID 65392807
1-(1-methoxy-4-methylcyclohexyl)-N-methylmethanamine
CID 62108000
1-[[methyl-[[4-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol
CID 114953505
[1-[(2,6-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexyl]methanamine
CID 113310568
1-(aminomethyl)-4-methylcyclohexan-1-amine
CID 43519520

Frequently Asked Questions

What is the IUPAC name of [4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine?
The IUPAC name of [4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine (CID 115442703) is [4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine.
What is the SMILES notation for [4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine?
The canonical SMILES for [4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine is CNCC1(CN)CCC(C)CC1.
What is the InChIKey of [4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine?
The InChIKey is IOHDOVUBZXASEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-9-3-5-10(7-11,6-4-9)8-12-2/h9,12H,3-8,11H2,1-2H3.
What are the key properties of [4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine?
[4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine has a molecular weight of 170.30 g/mol, XLogP of 1.36, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine is sourced from PubChem (CID 115442703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).