3-N-(1-methylcyclopentyl)pyridine-2,3-diamine

C11H17N3 — CID 104540031

IUPAC3-N-(1-methylcyclopentyl)pyridine-2,3-diamine
SMILESCC1(Nc2cccnc2N)CCCC1
InChIInChI=1S/C11H17N3/c1-11(6-2-3-7-11)14-9-5-4-8-13-10(9)12/h4-5,8,14H,2-3,6-7H2,1H3,(H2,12,13)
InChIKeyCOAFVSAHFHPUEF-UHFFFAOYSA-N
MW191.28 g/mol
LogP2.41
Rot. Bonds2

About 3-N-(1-methylcyclopentyl)pyridine-2,3-diamine

3-N-(1-methylcyclopentyl)pyridine-2,3-diamine (PubChem CID 104540031) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 3-N-(1-methylcyclopentyl)pyridine-2,3-diamine.

Molecular Properties

Compound Name3-N-(1-methylcyclopentyl)pyridine-2,3-diamine
PubChem CID104540031
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name3-N-(1-methylcyclopentyl)pyridine-2,3-diamine
SMILESCC1(Nc2cccnc2N)CCCC1
InChIInChI=1S/C11H17N3/c1-11(6-2-3-7-11)14-9-5-4-8-13-10(9)12/h4-5,8,14H,2-3,6-7H2,1H3,(H2,12,13)
InChIKeyCOAFVSAHFHPUEF-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

8-N-(1-methylcyclopentyl)quinoline-5,8-diamine
CID 61364592
3-N-(2,2-dimethylcyclohexyl)pyridine-2,3-diamine
CID 104540565
3-N-propan-2-ylpyridine-2,3-diamine
CID 58213244
3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine
CID 102985894
2-[[(1-methylcyclopentyl)amino]methyl]pyridin-3-amine
CID 104740135
3-N-(3-methylbutan-2-yl)pyridine-2,3-diamine
CID 104539778
3-bromo-1-N-(1-methylcyclobutyl)benzene-1,2-diamine
CID 130577498
1-N-(1-methylcyclopentyl)-3-methylsulfonylbenzene-1,2-diamine
CID 82002397
3-N-(2,2-dimethylthietan-3-yl)pyridine-2,3-diamine
CID 130964545
N-(1-methylcyclopentyl)-5-nitroquinolin-6-amine
CID 61366971
3-N-cyclohexylpyridine-2,3-diamine
CID 59587824
3-amino-N-(1-methylcyclobutyl)pyridine-2-sulfonamide
CID 103307414

Frequently Asked Questions

What is the IUPAC name of 3-N-(1-methylcyclopentyl)pyridine-2,3-diamine?
The IUPAC name of 3-N-(1-methylcyclopentyl)pyridine-2,3-diamine (CID 104540031) is 3-N-(1-methylcyclopentyl)pyridine-2,3-diamine.
What is the SMILES notation for 3-N-(1-methylcyclopentyl)pyridine-2,3-diamine?
The canonical SMILES for 3-N-(1-methylcyclopentyl)pyridine-2,3-diamine is CC1(Nc2cccnc2N)CCCC1.
What is the InChIKey of 3-N-(1-methylcyclopentyl)pyridine-2,3-diamine?
The InChIKey is COAFVSAHFHPUEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-11(6-2-3-7-11)14-9-5-4-8-13-10(9)12/h4-5,8,14H,2-3,6-7H2,1H3,(H2,12,13).
What are the key properties of 3-N-(1-methylcyclopentyl)pyridine-2,3-diamine?
3-N-(1-methylcyclopentyl)pyridine-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-(1-methylcyclopentyl)pyridine-2,3-diamine is sourced from PubChem (CID 104540031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).