(1-methyl-2H-pyridin-2-yl)methanamine

C7H12N2 — CID 69429778

IUPAC(1-methyl-2H-pyridin-2-yl)methanamine
SMILESCN1C=CC=CC1CN
InChIInChI=1S/C7H12N2/c1-9-5-3-2-4-7(9)6-8/h2-5,7H,6,8H2,1H3
InChIKeyVUDKYIDKMJPKEY-UHFFFAOYSA-N
MW124.19 g/mol
LogP0.33
Rot. Bonds1

About (1-methyl-2H-pyridin-2-yl)methanamine

(1-methyl-2H-pyridin-2-yl)methanamine (PubChem CID 69429778) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is (1-methyl-2H-pyridin-2-yl)methanamine.

Molecular Properties

Compound Name(1-methyl-2H-pyridin-2-yl)methanamine
PubChem CID69429778
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name(1-methyl-2H-pyridin-2-yl)methanamine
SMILESCN1C=CC=CC1CN
InChIInChI=1S/C7H12N2/c1-9-5-3-2-4-7(9)6-8/h2-5,7H,6,8H2,1H3
InChIKeyVUDKYIDKMJPKEY-UHFFFAOYSA-N
XLogP0.33
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-methyl-2H-pyridin-2-yl)methanamine?
The IUPAC name of (1-methyl-2H-pyridin-2-yl)methanamine (CID 69429778) is (1-methyl-2H-pyridin-2-yl)methanamine.
What is the SMILES notation for (1-methyl-2H-pyridin-2-yl)methanamine?
The canonical SMILES for (1-methyl-2H-pyridin-2-yl)methanamine is CN1C=CC=CC1CN.
What is the InChIKey of (1-methyl-2H-pyridin-2-yl)methanamine?
The InChIKey is VUDKYIDKMJPKEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-9-5-3-2-4-7(9)6-8/h2-5,7H,6,8H2,1H3.
What are the key properties of (1-methyl-2H-pyridin-2-yl)methanamine?
(1-methyl-2H-pyridin-2-yl)methanamine has a molecular weight of 124.19 g/mol, XLogP of 0.33, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methyl-2H-pyridin-2-yl)methanamine is sourced from PubChem (CID 69429778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).