N-(cyclopentylmethyl)-3-methoxy-6-methylpyridin-2-amine

C13H20N2O — CID 115908344

IUPACN-(cyclopentylmethyl)-3-methoxy-6-methylpyridin-2-amine
SMILESCOc1ccc(C)nc1NCC1CCCC1
InChIInChI=1S/C13H20N2O/c1-10-7-8-12(16-2)13(15-10)14-9-11-5-3-4-6-11/h7-8,11H,3-6,9H2,1-2H3,(H,14,15)
InChIKeyZLJRERAJLFBNGV-UHFFFAOYSA-N
MW220.32 g/mol
LogP3.00
Rot. Bonds4

About N-(cyclopentylmethyl)-3-methoxy-6-methylpyridin-2-amine

N-(cyclopentylmethyl)-3-methoxy-6-methylpyridin-2-amine (PubChem CID 115908344) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-3-methoxy-6-methylpyridin-2-amine.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-3-methoxy-6-methylpyridin-2-amine
PubChem CID115908344
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN-(cyclopentylmethyl)-3-methoxy-6-methylpyridin-2-amine
SMILESCOc1ccc(C)nc1NCC1CCCC1
InChIInChI=1S/C13H20N2O/c1-10-7-8-12(16-2)13(15-10)14-9-11-5-3-4-6-11/h7-8,11H,3-6,9H2,1-2H3,(H,14,15)
InChIKeyZLJRERAJLFBNGV-UHFFFAOYSA-N
XLogP3.00
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 ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-3-methoxy-6-methylpyridin-2-amine?
The IUPAC name of N-(cyclopentylmethyl)-3-methoxy-6-methylpyridin-2-amine (CID 115908344) is N-(cyclopentylmethyl)-3-methoxy-6-methylpyridin-2-amine.
What is the SMILES notation for N-(cyclopentylmethyl)-3-methoxy-6-methylpyridin-2-amine?
The canonical SMILES for N-(cyclopentylmethyl)-3-methoxy-6-methylpyridin-2-amine is COc1ccc(C)nc1NCC1CCCC1.
What is the InChIKey of N-(cyclopentylmethyl)-3-methoxy-6-methylpyridin-2-amine?
The InChIKey is ZLJRERAJLFBNGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10-7-8-12(16-2)13(15-10)14-9-11-5-3-4-6-11/h7-8,11H,3-6,9H2,1-2H3,(H,14,15).
What are the key properties of N-(cyclopentylmethyl)-3-methoxy-6-methylpyridin-2-amine?
N-(cyclopentylmethyl)-3-methoxy-6-methylpyridin-2-amine has a molecular weight of 220.32 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-3-methoxy-6-methylpyridin-2-amine is sourced from PubChem (CID 115908344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).