4-[(2-ethylimidazol-1-yl)methyl]-N-methylpyridin-2-amine

C12H16N4 — CID 62465996

IUPAC4-[(2-ethylimidazol-1-yl)methyl]-N-methylpyridin-2-amine
SMILESCCc1nccn1Cc1ccnc(NC)c1
InChIInChI=1S/C12H16N4/c1-3-12-15-6-7-16(12)9-10-4-5-14-11(8-10)13-2/h4-8H,3,9H2,1-2H3,(H,13,14)
InChIKeyMREJIFRKSZKXER-UHFFFAOYSA-N
MW216.29 g/mol
LogP1.93
Rot. Bonds4

About 4-[(2-ethylimidazol-1-yl)methyl]-N-methylpyridin-2-amine

4-[(2-ethylimidazol-1-yl)methyl]-N-methylpyridin-2-amine (PubChem CID 62465996) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 4-[(2-ethylimidazol-1-yl)methyl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name4-[(2-ethylimidazol-1-yl)methyl]-N-methylpyridin-2-amine
PubChem CID62465996
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name4-[(2-ethylimidazol-1-yl)methyl]-N-methylpyridin-2-amine
SMILESCCc1nccn1Cc1ccnc(NC)c1
InChIInChI=1S/C12H16N4/c1-3-12-15-6-7-16(12)9-10-4-5-14-11(8-10)13-2/h4-8H,3,9H2,1-2H3,(H,13,14)
InChIKeyMREJIFRKSZKXER-UHFFFAOYSA-N
XLogP1.93
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-4-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine
CID 62465995
4-[(2-ethylimidazol-1-yl)methyl]-N-propylpyridin-2-amine
CID 62465994
[4-[(2-ethylimidazol-1-yl)methyl]-2-pyridinyl]methanamine
CID 63889050
4-[(2-ethylimidazol-1-yl)methyl]pyridine-2-carbonitrile
CID 63881824
4-[(2-ethylimidazol-1-yl)methyl]pyridine
CID 63810514
N-methyl-4-[(2-thiophen-2-ylimidazol-1-yl)methyl]pyridin-2-amine
CID 55075721
1-[(3-bromophenyl)methyl]-2-ethylimidazole
CID 55150590
2-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]imidazole
CID 63811781
4-(indol-1-ylmethyl)-N-methylpyridin-2-amine
CID 141153764
[4-[(2-ethylimidazol-1-yl)methyl]phenyl]methanol
CID 110005702
4-(benzimidazol-1-ylmethyl)-N-methylpyridin-2-amine
CID 62466505
1-[[2-(methylamino)-4-pyridinyl]methyl]quinolin-4-one
CID 62465636

Frequently Asked Questions

What is the IUPAC name of 4-[(2-ethylimidazol-1-yl)methyl]-N-methylpyridin-2-amine?
The IUPAC name of 4-[(2-ethylimidazol-1-yl)methyl]-N-methylpyridin-2-amine (CID 62465996) is 4-[(2-ethylimidazol-1-yl)methyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 4-[(2-ethylimidazol-1-yl)methyl]-N-methylpyridin-2-amine?
The canonical SMILES for 4-[(2-ethylimidazol-1-yl)methyl]-N-methylpyridin-2-amine is CCc1nccn1Cc1ccnc(NC)c1.
What is the InChIKey of 4-[(2-ethylimidazol-1-yl)methyl]-N-methylpyridin-2-amine?
The InChIKey is MREJIFRKSZKXER-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-3-12-15-6-7-16(12)9-10-4-5-14-11(8-10)13-2/h4-8H,3,9H2,1-2H3,(H,13,14).
What are the key properties of 4-[(2-ethylimidazol-1-yl)methyl]-N-methylpyridin-2-amine?
4-[(2-ethylimidazol-1-yl)methyl]-N-methylpyridin-2-amine has a molecular weight of 216.29 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-ethylimidazol-1-yl)methyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 62465996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).