4-methyl-3-(6-methyl-3-pyridinyl)cyclohexan-1-amine

C13H20N2 — CID 165497311

IUPAC4-methyl-3-(6-methyl-3-pyridinyl)cyclohexan-1-amine
SMILESCc1ccc(C2CC(N)CCC2C)cn1
InChIInChI=1S/C13H20N2/c1-9-3-6-12(14)7-13(9)11-5-4-10(2)15-8-11/h4-5,8-9,12-13H,3,6-7,14H2,1-2H3
InChIKeyIITYSBNQMRTUSP-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.62
Rot. Bonds1

About 4-methyl-3-(6-methyl-3-pyridinyl)cyclohexan-1-amine

4-methyl-3-(6-methyl-3-pyridinyl)cyclohexan-1-amine (PubChem CID 165497311) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 4-methyl-3-(6-methyl-3-pyridinyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-methyl-3-(6-methyl-3-pyridinyl)cyclohexan-1-amine
PubChem CID165497311
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name4-methyl-3-(6-methyl-3-pyridinyl)cyclohexan-1-amine
SMILESCc1ccc(C2CC(N)CCC2C)cn1
InChIInChI=1S/C13H20N2/c1-9-3-6-12(14)7-13(9)11-5-4-10(2)15-8-11/h4-5,8-9,12-13H,3,6-7,14H2,1-2H3
InChIKeyIITYSBNQMRTUSP-UHFFFAOYSA-N
XLogP2.62
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(6-methyl-3-pyridinyl)cyclobutan-1-amine
CID 81013608
3-(6-methyl-3-pyridinyl)cyclohexan-1-amine
CID 64503423
2-(6-methyl-3-pyridinyl)cycloheptan-1-amine
CID 63156067
4-methyl-2-(6-methyl-3-pyridinyl)cyclohexane-1-carboxylic acid
CID 81020389
4-ethyl-2-(6-methyl-3-pyridinyl)cyclohexane-1-carboxylic acid
CID 81021300
4-methyl-3-(2-methylphenyl)cyclohexan-1-amine
CID 165497411
[2-(6-methyl-3-pyridinyl)cyclopropyl]methanol
CID 104824173
N,2-dimethyl-3-(6-methyl-3-pyridinyl)cyclopentan-1-amine
CID 64907454
2-methyl-5-(7-oxabicyclo[2.2.1]heptan-2-yl)pyridine
CID 166863614
4-tert-butyl-2-(6-methyl-3-pyridinyl)cyclohexane-1-carboxylic acid
CID 81020670
2-(6-methyl-3-pyridinyl)cyclohexane-1-carboxylic acid
CID 81008761
ethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine
CID 164882777

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-(6-methyl-3-pyridinyl)cyclohexan-1-amine?
The IUPAC name of 4-methyl-3-(6-methyl-3-pyridinyl)cyclohexan-1-amine (CID 165497311) is 4-methyl-3-(6-methyl-3-pyridinyl)cyclohexan-1-amine.
What is the SMILES notation for 4-methyl-3-(6-methyl-3-pyridinyl)cyclohexan-1-amine?
The canonical SMILES for 4-methyl-3-(6-methyl-3-pyridinyl)cyclohexan-1-amine is Cc1ccc(C2CC(N)CCC2C)cn1.
What is the InChIKey of 4-methyl-3-(6-methyl-3-pyridinyl)cyclohexan-1-amine?
The InChIKey is IITYSBNQMRTUSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-9-3-6-12(14)7-13(9)11-5-4-10(2)15-8-11/h4-5,8-9,12-13H,3,6-7,14H2,1-2H3.
What are the key properties of 4-methyl-3-(6-methyl-3-pyridinyl)cyclohexan-1-amine?
4-methyl-3-(6-methyl-3-pyridinyl)cyclohexan-1-amine has a molecular weight of 204.32 g/mol, XLogP of 2.62, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-(6-methyl-3-pyridinyl)cyclohexan-1-amine is sourced from PubChem (CID 165497311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).