2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine

C14H23N3O — CID 115320867

IUPAC2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine
SMILESCCC1CCC(Nc2nc(OC)ccc2N)C1C
InChIInChI=1S/C14H23N3O/c1-4-10-5-7-12(9(10)2)16-14-11(15)6-8-13(17-14)18-3/h6,8-10,12H,4-5,7,15H2,1-3H3,(H,16,17)
InChIKeyZQRNHUKMHAGRTE-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.91
Rot. Bonds4

About 2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine

2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine (PubChem CID 115320867) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine.

Molecular Properties

Compound Name2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine
PubChem CID115320867
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine
SMILESCCC1CCC(Nc2nc(OC)ccc2N)C1C
InChIInChI=1S/C14H23N3O/c1-4-10-5-7-12(9(10)2)16-14-11(15)6-8-13(17-14)18-3/h6,8-10,12H,4-5,7,15H2,1-3H3,(H,16,17)
InChIKeyZQRNHUKMHAGRTE-UHFFFAOYSA-N
XLogP2.91
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxylic acid
CID 114406820
6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine
CID 113286375
2-N-cyclohexyl-6-methoxypyridine-2,3-diamine
CID 115320270
6-methoxy-2-N-(3-tricyclo[3.2.1.02,4]octanyl)pyridine-2,3-diamine
CID 114095356
N-(3-ethyl-2-methylcyclopentyl)-7-methoxyisoquinolin-1-amine
CID 106538857
2-N-(1-ethylpiperidin-3-yl)-6-methoxypyridine-2,3-diamine
CID 113286474
5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-3-carboxylic acid
CID 81439688
6-methoxy-2-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)pyridine-2,3-diamine
CID 115320849
2-N-(3-ethyl-2-methylcyclopentyl)pyridine-2,5-diamine
CID 64922502
[2-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol
CID 113286599
6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride
CID 22731600
4-N-(3-ethyl-2-methylcyclopentyl)quinazoline-4,6-diamine
CID 64921714

Frequently Asked Questions

What is the IUPAC name of 2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine?
The IUPAC name of 2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine (CID 115320867) is 2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine.
What is the SMILES notation for 2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine?
The canonical SMILES for 2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine is CCC1CCC(Nc2nc(OC)ccc2N)C1C.
What is the InChIKey of 2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine?
The InChIKey is ZQRNHUKMHAGRTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-4-10-5-7-12(9(10)2)16-14-11(15)6-8-13(17-14)18-3/h6,8-10,12H,4-5,7,15H2,1-3H3,(H,16,17).
What are the key properties of 2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine?
2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine has a molecular weight of 249.36 g/mol, XLogP of 2.91, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine is sourced from PubChem (CID 115320867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).