3-N-cyclohexylpyridine-2,3-diamine

C11H17N3 — CID 59587824

IUPAC3-N-cyclohexylpyridine-2,3-diamine
SMILESNc1ncccc1NC1CCCCC1
InChIInChI=1S/C11H17N3/c12-11-10(7-4-8-13-11)14-9-5-2-1-3-6-9/h4,7-9,14H,1-3,5-6H2,(H2,12,13)
InChIKeyCLWPVXLYGATKMF-UHFFFAOYSA-N
MW191.28 g/mol
LogP2.41
Rot. Bonds2

About 3-N-cyclohexylpyridine-2,3-diamine

3-N-cyclohexylpyridine-2,3-diamine (PubChem CID 59587824) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 3-N-cyclohexylpyridine-2,3-diamine.

Molecular Properties

Compound Name3-N-cyclohexylpyridine-2,3-diamine
PubChem CID59587824
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name3-N-cyclohexylpyridine-2,3-diamine
SMILESNc1ncccc1NC1CCCCC1
InChIInChI=1S/C11H17N3/c12-11-10(7-4-8-13-11)14-9-5-2-1-3-6-9/h4,7-9,14H,1-3,5-6H2,(H2,12,13)
InChIKeyCLWPVXLYGATKMF-UHFFFAOYSA-N
XLogP2.41
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-(3-bicyclo[3.1.0]hexanyl)pyridine-2,3-diamine
CID 130791635
3-N-cyclohexylbenzene-1,2,3-triamine
CID 14942290
3-N-(2-cyclohexyloxyethyl)pyridine-2,3-diamine
CID 104540407
3-N-(2,2-dimethylcyclohexyl)pyridine-2,3-diamine
CID 104540565
N-cyclopentyl-2-methoxypyridin-3-amine
CID 43721756
3-N-(2-methyloxolan-3-yl)pyridine-2,3-diamine
CID 104540640
3-N-(2-bicyclo[2.2.1]heptanyl)pyridine-2,3-diamine
CID 104540446
N-cyclohexyl-2-(2-phenylethynyl)pyridin-3-amine
CID 135062948
4-[(2-amino-3-pyridinyl)amino]oxolan-3-ol
CID 130688470
N-cyclopentyl-2-iodoaniline;2-iodoaniline
CID 159046198
3-[(2-amino-3-pyridinyl)amino]piperidine-2,6-dione
CID 104540520
3-N-(2,2-dimethylthietan-3-yl)pyridine-2,3-diamine
CID 130964545

Frequently Asked Questions

What is the IUPAC name of 3-N-cyclohexylpyridine-2,3-diamine?
The IUPAC name of 3-N-cyclohexylpyridine-2,3-diamine (CID 59587824) is 3-N-cyclohexylpyridine-2,3-diamine.
What is the SMILES notation for 3-N-cyclohexylpyridine-2,3-diamine?
The canonical SMILES for 3-N-cyclohexylpyridine-2,3-diamine is Nc1ncccc1NC1CCCCC1.
What is the InChIKey of 3-N-cyclohexylpyridine-2,3-diamine?
The InChIKey is CLWPVXLYGATKMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c12-11-10(7-4-8-13-11)14-9-5-2-1-3-6-9/h4,7-9,14H,1-3,5-6H2,(H2,12,13).
What are the key properties of 3-N-cyclohexylpyridine-2,3-diamine?
3-N-cyclohexylpyridine-2,3-diamine has a molecular weight of 191.28 g/mol, XLogP of 2.41, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-cyclohexylpyridine-2,3-diamine is sourced from PubChem (CID 59587824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).