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

C13H21N3 — CID 107416546

IUPAC3-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine
SMILESCc1cc(N)cnc1NCC1CCCC1C
InChIInChI=1S/C13H21N3/c1-9-4-3-5-11(9)7-15-13-10(2)6-12(14)8-16-13/h6,8-9,11H,3-5,7,14H2,1-2H3,(H,15,16)
InChIKeyBBRUEYIASCOATE-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.82
Rot. Bonds3

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

3-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine (PubChem CID 107416546) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 3-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine.

Molecular Properties

Compound Name3-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine
PubChem CID107416546
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name3-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine
SMILESCc1cc(N)cnc1NCC1CCCC1C
InChIInChI=1S/C13H21N3/c1-9-4-3-5-11(9)7-15-13-10(2)6-12(14)8-16-13/h6,8-9,11H,3-5,7,14H2,1-2H3,(H,15,16)
InChIKeyBBRUEYIASCOATE-UHFFFAOYSA-N
XLogP2.82
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-2-[(2-methylcyclopentyl)methylamino]pyridine-3-carboxylic acid
CID 114047478
2-N-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylpyridine-2,5-diamine
CID 63689946
5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine
CID 66278219
3-methyl-2-N-[(4-methylcyclohexyl)methyl]pyridine-2,5-diamine
CID 55176213
5-methyl-4-N-[(2-methylcyclohexyl)methyl]pyrimidine-2,4-diamine
CID 80815292
3-methyl-2-N-(oxolan-2-ylmethyl)pyridine-2,5-diamine
CID 62476856
4-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine
CID 107416554
3-methyl-2-N-(oxan-4-ylmethyl)pyridine-2,5-diamine
CID 63726632
4-N-[(2-methylcyclopentyl)methyl]pyrimidine-4,5-diamine
CID 107416529
3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine
CID 107419343
3-methyl-2-N-[(1-methylpiperidin-3-yl)methyl]pyridine-2,5-diamine
CID 55080788
5-methyl-4-N-[(2-methylcyclohexyl)methyl]pyrimidine-4,6-diamine
CID 80815368

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine?
The IUPAC name of 3-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine (CID 107416546) is 3-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine.
What is the SMILES notation for 3-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine?
The canonical SMILES for 3-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine is Cc1cc(N)cnc1NCC1CCCC1C.
What is the InChIKey of 3-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine?
The InChIKey is BBRUEYIASCOATE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-9-4-3-5-11(9)7-15-13-10(2)6-12(14)8-16-13/h6,8-9,11H,3-5,7,14H2,1-2H3,(H,15,16).
What are the key properties of 3-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine?
3-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine has a molecular weight of 219.33 g/mol, XLogP of 2.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine is sourced from PubChem (CID 107416546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).