5-N-(3-ethylcyclohexyl)-3-N-methylpyridine-3,5-diamine

C14H23N3 — CID 104534936

IUPAC5-N-(3-ethylcyclohexyl)-3-N-methylpyridine-3,5-diamine
SMILESCCC1CCCC(Nc2cncc(NC)c2)C1
InChIInChI=1S/C14H23N3/c1-3-11-5-4-6-12(7-11)17-14-8-13(15-2)9-16-10-14/h8-12,15,17H,3-7H2,1-2H3
InChIKeyHCUBSXHZCDWMAP-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.50
Rot. Bonds4

About 5-N-(3-ethylcyclohexyl)-3-N-methylpyridine-3,5-diamine

5-N-(3-ethylcyclohexyl)-3-N-methylpyridine-3,5-diamine (PubChem CID 104534936) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 5-N-(3-ethylcyclohexyl)-3-N-methylpyridine-3,5-diamine.

Molecular Properties

Compound Name5-N-(3-ethylcyclohexyl)-3-N-methylpyridine-3,5-diamine
PubChem CID104534936
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name5-N-(3-ethylcyclohexyl)-3-N-methylpyridine-3,5-diamine
SMILESCCC1CCCC(Nc2cncc(NC)c2)C1
InChIInChI=1S/C14H23N3/c1-3-11-5-4-6-12(7-11)17-14-8-13(15-2)9-16-10-14/h8-12,15,17H,3-7H2,1-2H3
InChIKeyHCUBSXHZCDWMAP-UHFFFAOYSA-N
XLogP3.50
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-methyl-5-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3,5-diamine
CID 104535034
3-N-methyl-5-N-(oxan-3-yl)pyridine-3,5-diamine
CID 104534608
4-N-(3-ethylcyclohexyl)-6-N,2-dimethylpyrimidine-4,6-diamine
CID 80840628
5-bromo-N-(3-ethylcyclobutyl)pyridin-3-amine
CID 130978854
3-N-ethyl-5-N-(4-ethylcyclohexyl)pyridine-3,5-diamine
CID 104533446
2-N-(3-ethylcyclohexyl)-6-N-propylpyrazine-2,6-diamine
CID 80840757
cis-(1R,3S)-3-ethyl-N-methylcyclohexan-1-amine
CID 129149436
4-[(3-ethylcyclohexyl)amino]pyridine-2-carboxylic acid
CID 64749962
5-[(3-ethylcyclohexyl)amino]pyridine-2-carbothioamide
CID 115488665
1-ethyl-N-(3-ethylcyclohexyl)imidazol-2-amine
CID 64742243
4-bromo-N-(3-ethylcyclohexyl)-3-fluoroaniline
CID 65435528
4-[(3-ethylcyclohexyl)amino]benzene-1,2-dicarbonitrile
CID 107788181

Frequently Asked Questions

What is the IUPAC name of 5-N-(3-ethylcyclohexyl)-3-N-methylpyridine-3,5-diamine?
The IUPAC name of 5-N-(3-ethylcyclohexyl)-3-N-methylpyridine-3,5-diamine (CID 104534936) is 5-N-(3-ethylcyclohexyl)-3-N-methylpyridine-3,5-diamine.
What is the SMILES notation for 5-N-(3-ethylcyclohexyl)-3-N-methylpyridine-3,5-diamine?
The canonical SMILES for 5-N-(3-ethylcyclohexyl)-3-N-methylpyridine-3,5-diamine is CCC1CCCC(Nc2cncc(NC)c2)C1.
What is the InChIKey of 5-N-(3-ethylcyclohexyl)-3-N-methylpyridine-3,5-diamine?
The InChIKey is HCUBSXHZCDWMAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-3-11-5-4-6-12(7-11)17-14-8-13(15-2)9-16-10-14/h8-12,15,17H,3-7H2,1-2H3.
What are the key properties of 5-N-(3-ethylcyclohexyl)-3-N-methylpyridine-3,5-diamine?
5-N-(3-ethylcyclohexyl)-3-N-methylpyridine-3,5-diamine has a molecular weight of 233.36 g/mol, XLogP of 3.50, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(3-ethylcyclohexyl)-3-N-methylpyridine-3,5-diamine is sourced from PubChem (CID 104534936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).