2-methyl-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine

C11H16N2 — CID 62332060

IUPAC2-methyl-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine
SMILESC=C(C)CNCc1cccc(C)n1
InChIInChI=1S/C11H16N2/c1-9(2)7-12-8-11-6-4-5-10(3)13-11/h4-6,12H,1,7-8H2,2-3H3
InChIKeyFPEYBQNEJMNYCI-UHFFFAOYSA-N
MW176.26 g/mol
LogP2.06
Rot. Bonds4

About 2-methyl-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine

2-methyl-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine (PubChem CID 62332060) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 2-methyl-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine.

Molecular Properties

Compound Name2-methyl-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine
PubChem CID62332060
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name2-methyl-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine
SMILESC=C(C)CNCc1cccc(C)n1
InChIInChI=1S/C11H16N2/c1-9(2)7-12-8-11-6-4-5-10(3)13-11/h4-6,12H,1,7-8H2,2-3H3
InChIKeyFPEYBQNEJMNYCI-UHFFFAOYSA-N
XLogP2.06
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-bromo-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine
CID 62322148
1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine
CID 15491901
N'-[(6-methyl-2-pyridinyl)methyl]ethane-1,2-diamine
CID 14280569
2-[2-[(6-methyl-2-pyridinyl)methylamino]ethoxy]ethanol
CID 62323741
N-[(6-methyl-2-pyridinyl)methyl]-1-pyridin-2-ylmethanamine
CID 15900109
(E)-3-chloro-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine
CID 107899871
3-[(6-methyl-2-pyridinyl)methylamino]propanamide
CID 62323562
4-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclohexan-1-ol
CID 106133296
1-(4-ethylcyclohexyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine
CID 79267415
2-methyl-N-[(6-methyl-2-pyridinyl)methyl]-3-methylsulfanylpropan-1-amine
CID 79267876
N-[(6-methyl-2-pyridinyl)methyl]-3-methylsulfanylpropan-1-amine
CID 60961143
1-(2-ethylphenyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine
CID 62390547

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine?
The IUPAC name of 2-methyl-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine (CID 62332060) is 2-methyl-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine.
What is the SMILES notation for 2-methyl-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine?
The canonical SMILES for 2-methyl-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine is C=C(C)CNCc1cccc(C)n1.
What is the InChIKey of 2-methyl-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine?
The InChIKey is FPEYBQNEJMNYCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-9(2)7-12-8-11-6-4-5-10(3)13-11/h4-6,12H,1,7-8H2,2-3H3.
What are the key properties of 2-methyl-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine?
2-methyl-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine has a molecular weight of 176.26 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(6-methyl-2-pyridinyl)methyl]prop-2-en-1-amine is sourced from PubChem (CID 62332060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).