6-methoxy-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine

C13H20N2O — CID 107419078

IUPAC6-methoxy-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine
SMILESCOc1cccc(NCC2CCCC2C)n1
InChIInChI=1S/C13H20N2O/c1-10-5-3-6-11(10)9-14-12-7-4-8-13(15-12)16-2/h4,7-8,10-11H,3,5-6,9H2,1-2H3,(H,14,15)
InChIKeyKYWQOKOUUXSQOJ-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.94
Rot. Bonds4

About 6-methoxy-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine

6-methoxy-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine (PubChem CID 107419078) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 6-methoxy-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name6-methoxy-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine
PubChem CID107419078
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name6-methoxy-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine
SMILESCOc1cccc(NCC2CCCC2C)n1
InChIInChI=1S/C13H20N2O/c1-10-5-3-6-11(10)9-14-12-7-4-8-13(15-12)16-2/h4,7-8,10-11H,3,5-6,9H2,1-2H3,(H,14,15)
InChIKeyKYWQOKOUUXSQOJ-UHFFFAOYSA-N
XLogP2.94
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine?
The IUPAC name of 6-methoxy-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine (CID 107419078) is 6-methoxy-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine.
What is the SMILES notation for 6-methoxy-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine?
The canonical SMILES for 6-methoxy-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine is COc1cccc(NCC2CCCC2C)n1.
What is the InChIKey of 6-methoxy-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine?
The InChIKey is KYWQOKOUUXSQOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10-5-3-6-11(10)9-14-12-7-4-8-13(15-12)16-2/h4,7-8,10-11H,3,5-6,9H2,1-2H3,(H,14,15).
What are the key properties of 6-methoxy-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine?
6-methoxy-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine has a molecular weight of 220.32 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine is sourced from PubChem (CID 107419078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).