4-methyl-N-[(1R,2R)-2-methylcyclohexyl]pyridin-3-amine

C13H20N2 — CID 95379111

IUPAC4-methyl-N-[(1R,2R)-2-methylcyclohexyl]pyridin-3-amine
SMILESCc1ccncc1N[C@@H]1CCCC[C@H]1C
InChIInChI=1S/C13H20N2/c1-10-5-3-4-6-12(10)15-13-9-14-8-7-11(13)2/h7-10,12,15H,3-6H2,1-2H3/t10-,12-/m1/s1
InChIKeyZSUIFHARQCCEMF-ZYHUDNBSSA-N
MW204.32 g/mol
LogP3.38
Rot. Bonds2

About 4-methyl-N-[(1R,2R)-2-methylcyclohexyl]pyridin-3-amine

4-methyl-N-[(1R,2R)-2-methylcyclohexyl]pyridin-3-amine (PubChem CID 95379111) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 4-methyl-N-[(1R,2R)-2-methylcyclohexyl]pyridin-3-amine.

Molecular Properties

Compound Name4-methyl-N-[(1R,2R)-2-methylcyclohexyl]pyridin-3-amine
PubChem CID95379111
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name4-methyl-N-[(1R,2R)-2-methylcyclohexyl]pyridin-3-amine
SMILESCc1ccncc1N[C@@H]1CCCC[C@H]1C
InChIInChI=1S/C13H20N2/c1-10-5-3-4-6-12(10)15-13-9-14-8-7-11(13)2/h7-10,12,15H,3-6H2,1-2H3/t10-,12-/m1/s1
InChIKeyZSUIFHARQCCEMF-ZYHUDNBSSA-N
XLogP3.38
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,5-dimethylcyclohexyl)-4-methylpyridin-3-amine
CID 64762714
N-(2-methylcyclopentyl)pyridin-4-amine
CID 63281266
3-N-(2,3-dimethylcyclohexyl)-4-N,4-N-dimethylpyridine-3,4-diamine
CID 64761401
2,6-dimethyl-3-[(2-methylcyclohexyl)amino]phenol
CID 43741722
4-methyl-N-(1-oxothian-4-yl)pyridin-3-amine
CID 63329562
3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide
CID 105070514
5-methyl-N-(2-methylcyclohexyl)pyrimidin-2-amine
CID 63208068
5-methyl-4-N-[(1S,2R)-2-methylcyclohexyl]pyridine-2,3,4-triamine
CID 67278428
4-methyl-N-[(2-methylcyclopropyl)methyl]pyridin-3-amine
CID 130693325
N-(2-methylcyclohexyl)pyridazin-3-amine
CID 62481216
5-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-b]pyridazin-4-amine
CID 67966573
3-cycloheptyl-4-methylpyridine
CID 146408954

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(1R,2R)-2-methylcyclohexyl]pyridin-3-amine?
The IUPAC name of 4-methyl-N-[(1R,2R)-2-methylcyclohexyl]pyridin-3-amine (CID 95379111) is 4-methyl-N-[(1R,2R)-2-methylcyclohexyl]pyridin-3-amine.
What is the SMILES notation for 4-methyl-N-[(1R,2R)-2-methylcyclohexyl]pyridin-3-amine?
The canonical SMILES for 4-methyl-N-[(1R,2R)-2-methylcyclohexyl]pyridin-3-amine is Cc1ccncc1N[C@@H]1CCCC[C@H]1C.
What is the InChIKey of 4-methyl-N-[(1R,2R)-2-methylcyclohexyl]pyridin-3-amine?
The InChIKey is ZSUIFHARQCCEMF-ZYHUDNBSSA-N. The full InChI is InChI=1S/C13H20N2/c1-10-5-3-4-6-12(10)15-13-9-14-8-7-11(13)2/h7-10,12,15H,3-6H2,1-2H3/t10-,12-/m1/s1.
What are the key properties of 4-methyl-N-[(1R,2R)-2-methylcyclohexyl]pyridin-3-amine?
4-methyl-N-[(1R,2R)-2-methylcyclohexyl]pyridin-3-amine has a molecular weight of 204.32 g/mol, XLogP of 3.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(1R,2R)-2-methylcyclohexyl]pyridin-3-amine is sourced from PubChem (CID 95379111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).