N-(1,2-dihydropyridin-6-ylmethyl)-N-methylethenamine

C9H14N2 — CID 167486413

IUPACN-(1,2-dihydropyridin-6-ylmethyl)-N-methylethenamine
SMILESC=CN(C)CC1=CC=CCN1
InChIInChI=1S/C9H14N2/c1-3-11(2)8-9-6-4-5-7-10-9/h3-6,10H,1,7-8H2,2H3
InChIKeyBCJBDXBDQMDODW-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.11
Rot. Bonds3

About N-(1,2-dihydropyridin-6-ylmethyl)-N-methylethenamine

N-(1,2-dihydropyridin-6-ylmethyl)-N-methylethenamine (PubChem CID 167486413) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is N-(1,2-dihydropyridin-6-ylmethyl)-N-methylethenamine.

Molecular Properties

Compound NameN-(1,2-dihydropyridin-6-ylmethyl)-N-methylethenamine
PubChem CID167486413
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC NameN-(1,2-dihydropyridin-6-ylmethyl)-N-methylethenamine
SMILESC=CN(C)CC1=CC=CCN1
InChIInChI=1S/C9H14N2/c1-3-11(2)8-9-6-4-5-7-10-9/h3-6,10H,1,7-8H2,2H3
InChIKeyBCJBDXBDQMDODW-UHFFFAOYSA-N
XLogP1.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1,2-dihydropyridin-6-ylmethyl)-N-methylethenamine?
The IUPAC name of N-(1,2-dihydropyridin-6-ylmethyl)-N-methylethenamine (CID 167486413) is N-(1,2-dihydropyridin-6-ylmethyl)-N-methylethenamine.
What is the SMILES notation for N-(1,2-dihydropyridin-6-ylmethyl)-N-methylethenamine?
The canonical SMILES for N-(1,2-dihydropyridin-6-ylmethyl)-N-methylethenamine is C=CN(C)CC1=CC=CCN1.
What is the InChIKey of N-(1,2-dihydropyridin-6-ylmethyl)-N-methylethenamine?
The InChIKey is BCJBDXBDQMDODW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-3-11(2)8-9-6-4-5-7-10-9/h3-6,10H,1,7-8H2,2H3.
What are the key properties of N-(1,2-dihydropyridin-6-ylmethyl)-N-methylethenamine?
N-(1,2-dihydropyridin-6-ylmethyl)-N-methylethenamine has a molecular weight of 150.22 g/mol, XLogP of 1.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-dihydropyridin-6-ylmethyl)-N-methylethenamine is sourced from PubChem (CID 167486413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).