N-methyl-1-(3-methylcyclohexyl)-1-(3-methylimidazol-4-yl)methanamine

C13H23N3 — CID 82903742

IUPACN-methyl-1-(3-methylcyclohexyl)-1-(3-methylimidazol-4-yl)methanamine
SMILESCNC(c1cncn1C)C1CCCC(C)C1
InChIInChI=1S/C13H23N3/c1-10-5-4-6-11(7-10)13(14-2)12-8-15-9-16(12)3/h8-11,13-14H,4-7H2,1-3H3
InChIKeySJDFNLHNIQCWTH-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.51
Rot. Bonds3

About N-methyl-1-(3-methylcyclohexyl)-1-(3-methylimidazol-4-yl)methanamine

N-methyl-1-(3-methylcyclohexyl)-1-(3-methylimidazol-4-yl)methanamine (PubChem CID 82903742) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is N-methyl-1-(3-methylcyclohexyl)-1-(3-methylimidazol-4-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(3-methylcyclohexyl)-1-(3-methylimidazol-4-yl)methanamine
PubChem CID82903742
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC NameN-methyl-1-(3-methylcyclohexyl)-1-(3-methylimidazol-4-yl)methanamine
SMILESCNC(c1cncn1C)C1CCCC(C)C1
InChIInChI=1S/C13H23N3/c1-10-5-4-6-11(7-10)13(14-2)12-8-15-9-16(12)3/h8-11,13-14H,4-7H2,1-3H3
InChIKeySJDFNLHNIQCWTH-UHFFFAOYSA-N
XLogP2.51
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cycloheptyl-N-methyl-1-(3-methylimidazol-4-yl)methanamine
CID 82932122
1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-(3-methylcyclohexyl)methanamine
CID 105155982
1-(3-ethyl-1-methylpyrazol-5-yl)-N-methyl-1-(3-methylcyclohexyl)methanamine
CID 105155802
N-methyl-1-(3-methylcyclohexyl)-1-pyrazolo[1,5-a]pyridin-3-ylmethanamine
CID 103127395
cyclopentyl-(3-methylimidazol-4-yl)methanol
CID 66118415
N-[(3-methylcyclohexyl)-(2-methyltriazol-4-yl)methyl]propan-1-amine
CID 112735849
N-[(2,5-dimethylpyrazol-3-yl)-(3-methylcyclohexyl)methyl]ethanamine
CID 105155834
(3-ethylcyclohexyl)-(3-methylimidazol-4-yl)methanol
CID 66117130
1-(4-ethylphenyl)-N-methyl-1-(3-methylcyclohexyl)methanamine
CID 63414820
1-(2-cyclobutylphenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine
CID 114604500
N-methyl-1-(3-methylcyclohexyl)-1-(3-methylfuran-2-yl)methanamine
CID 104804739
[(3-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine
CID 105210469

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-methylcyclohexyl)-1-(3-methylimidazol-4-yl)methanamine?
The IUPAC name of N-methyl-1-(3-methylcyclohexyl)-1-(3-methylimidazol-4-yl)methanamine (CID 82903742) is N-methyl-1-(3-methylcyclohexyl)-1-(3-methylimidazol-4-yl)methanamine.
What is the SMILES notation for N-methyl-1-(3-methylcyclohexyl)-1-(3-methylimidazol-4-yl)methanamine?
The canonical SMILES for N-methyl-1-(3-methylcyclohexyl)-1-(3-methylimidazol-4-yl)methanamine is CNC(c1cncn1C)C1CCCC(C)C1.
What is the InChIKey of N-methyl-1-(3-methylcyclohexyl)-1-(3-methylimidazol-4-yl)methanamine?
The InChIKey is SJDFNLHNIQCWTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-10-5-4-6-11(7-10)13(14-2)12-8-15-9-16(12)3/h8-11,13-14H,4-7H2,1-3H3.
What are the key properties of N-methyl-1-(3-methylcyclohexyl)-1-(3-methylimidazol-4-yl)methanamine?
N-methyl-1-(3-methylcyclohexyl)-1-(3-methylimidazol-4-yl)methanamine has a molecular weight of 221.35 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-methylcyclohexyl)-1-(3-methylimidazol-4-yl)methanamine is sourced from PubChem (CID 82903742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).