N-(azetidin-3-ylmethyl)-3-methylpyridin-4-amine

C10H15N3 — CID 130854740

IUPACN-(azetidin-3-ylmethyl)-3-methylpyridin-4-amine
SMILESCc1cnccc1NCC1CNC1
InChIInChI=1S/C10H15N3/c1-8-4-11-3-2-10(8)13-7-9-5-12-6-9/h2-4,9,12H,5-7H2,1H3,(H,11,13)
InChIKeyPFZVPJXRWXKWIR-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.02
Rot. Bonds3

About N-(azetidin-3-ylmethyl)-3-methylpyridin-4-amine

N-(azetidin-3-ylmethyl)-3-methylpyridin-4-amine (PubChem CID 130854740) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is N-(azetidin-3-ylmethyl)-3-methylpyridin-4-amine.

Molecular Properties

Compound NameN-(azetidin-3-ylmethyl)-3-methylpyridin-4-amine
PubChem CID130854740
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC NameN-(azetidin-3-ylmethyl)-3-methylpyridin-4-amine
SMILESCc1cnccc1NCC1CNC1
InChIInChI=1S/C10H15N3/c1-8-4-11-3-2-10(8)13-7-9-5-12-6-9/h2-4,9,12H,5-7H2,1H3,(H,11,13)
InChIKeyPFZVPJXRWXKWIR-UHFFFAOYSA-N
XLogP1.02
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-ylmethyl)-3-methylpyridin-4-amine?
The IUPAC name of N-(azetidin-3-ylmethyl)-3-methylpyridin-4-amine (CID 130854740) is N-(azetidin-3-ylmethyl)-3-methylpyridin-4-amine.
What is the SMILES notation for N-(azetidin-3-ylmethyl)-3-methylpyridin-4-amine?
The canonical SMILES for N-(azetidin-3-ylmethyl)-3-methylpyridin-4-amine is Cc1cnccc1NCC1CNC1.
What is the InChIKey of N-(azetidin-3-ylmethyl)-3-methylpyridin-4-amine?
The InChIKey is PFZVPJXRWXKWIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-8-4-11-3-2-10(8)13-7-9-5-12-6-9/h2-4,9,12H,5-7H2,1H3,(H,11,13).
What are the key properties of N-(azetidin-3-ylmethyl)-3-methylpyridin-4-amine?
N-(azetidin-3-ylmethyl)-3-methylpyridin-4-amine has a molecular weight of 177.25 g/mol, XLogP of 1.02, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-ylmethyl)-3-methylpyridin-4-amine is sourced from PubChem (CID 130854740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).