5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine

C14H23N3 — CID 66278219

IUPAC5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine
SMILESCc1cnc(NCC2CCCCC2C)c(N)c1
InChIInChI=1S/C14H23N3/c1-10-7-13(15)14(16-8-10)17-9-12-6-4-3-5-11(12)2/h7-8,11-12H,3-6,9,15H2,1-2H3,(H,16,17)
InChIKeyGPSYYCVXLUEEPT-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.21
Rot. Bonds3

About 5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine

5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine (PubChem CID 66278219) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine.

Molecular Properties

Compound Name5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine
PubChem CID66278219
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine
SMILESCc1cnc(NCC2CCCCC2C)c(N)c1
InChIInChI=1S/C14H23N3/c1-10-7-13(15)14(16-8-10)17-9-12-6-4-3-5-11(12)2/h7-8,11-12H,3-6,9,15H2,1-2H3,(H,16,17)
InChIKeyGPSYYCVXLUEEPT-UHFFFAOYSA-N
XLogP3.21
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol
CID 66278240
2-N-(cyclopropylmethyl)-5-methylpyridine-2,3-diamine
CID 66281261
3-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine
CID 107416546
4-N-[(2-methylcyclopentyl)methyl]pyrimidine-4,5-diamine
CID 107416529
5-methyl-2-N-(thian-2-ylmethyl)pyridine-2,3-diamine
CID 80596479
5-methyl-4-N-[(2-methylcyclohexyl)methyl]pyrimidine-2,4-diamine
CID 80815292
5-methyl-4-N-[(2-methylcyclohexyl)methyl]pyrimidine-4,6-diamine
CID 80815368
5-methyl-N-[(2-methylcyclopentyl)methyl]pyridazin-3-amine
CID 107419285
4-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine
CID 107416554
5-methyl-2-N-[(1-methylpiperidin-3-yl)methyl]pyridine-2,3-diamine
CID 66279532
5-methyl-3-N-[(2-methylcyclohexyl)methyl]benzene-1,3-diamine
CID 112647560
6-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,3-diamine
CID 107416531

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine?
The IUPAC name of 5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine (CID 66278219) is 5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine.
What is the SMILES notation for 5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine?
The canonical SMILES for 5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine is Cc1cnc(NCC2CCCCC2C)c(N)c1.
What is the InChIKey of 5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine?
The InChIKey is GPSYYCVXLUEEPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-10-7-13(15)14(16-8-10)17-9-12-6-4-3-5-11(12)2/h7-8,11-12H,3-6,9,15H2,1-2H3,(H,16,17).
What are the key properties of 5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine?
5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine has a molecular weight of 233.36 g/mol, XLogP of 3.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine is sourced from PubChem (CID 66278219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).