4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine

C15H17N5 — CID 106573444

IUPAC4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine
SMILESCc1cn(-c2ccccc2)c(NCc2nccn2C)n1
InChIInChI=1S/C15H17N5/c1-12-11-20(13-6-4-3-5-7-13)15(18-12)17-10-14-16-8-9-19(14)2/h3-9,11H,10H2,1-2H3,(H,17,18)
InChIKeyHJORUWAMJJCPRF-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.53
Rot. Bonds4

About 4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine

4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine (PubChem CID 106573444) has the molecular formula C15H17N5 and a molecular weight of 267.34 g/mol. Its IUPAC name is 4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine.

Molecular Properties

Compound Name4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine
PubChem CID106573444
Molecular FormulaC15H17N5
Molecular Weight267.34 g/mol
Exact Mass267.15
IUPAC Name4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine
SMILESCc1cn(-c2ccccc2)c(NCc2nccn2C)n1
InChIInChI=1S/C15H17N5/c1-12-11-20(13-6-4-3-5-7-13)15(18-12)17-10-14-16-8-9-19(14)2/h3-9,11H,10H2,1-2H3,(H,17,18)
InChIKeyHJORUWAMJJCPRF-UHFFFAOYSA-N
XLogP2.53
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-1-phenyl-N-(3-pyrazol-1-ylpropyl)imidazol-2-amine
CID 106579674
4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine
CID 106554707
N-[(5-chlorothiophen-2-yl)methyl]-4-methyl-1-phenylimidazol-2-amine
CID 106575438
N',N'-dimethyl-N-(4-methyl-1-phenylimidazol-2-yl)ethane-1,2-diamine
CID 106555123
N-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine
CID 106581312
N-[(1-methylimidazol-2-yl)methyl]naphthalen-1-amine
CID 43087970
N-[(1-methylimidazol-2-yl)methyl]-1,3-benzothiazol-2-amine
CID 63239425
4-methyl-N-(2-methylsulfinylethyl)-1-phenylimidazol-2-amine
CID 106581417
2,6-difluoro-N-[(1-methylimidazol-2-yl)methyl]aniline
CID 43088131
3-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine
CID 83062959
2-chloro-N-[(1-methylimidazol-2-yl)methyl]aniline
CID 43087854
2-N-methyl-6-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,6-diamine
CID 80829255

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine?
The IUPAC name of 4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine (CID 106573444) is 4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine.
What is the SMILES notation for 4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine?
The canonical SMILES for 4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine is Cc1cn(-c2ccccc2)c(NCc2nccn2C)n1.
What is the InChIKey of 4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine?
The InChIKey is HJORUWAMJJCPRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5/c1-12-11-20(13-6-4-3-5-7-13)15(18-12)17-10-14-16-8-9-19(14)2/h3-9,11H,10H2,1-2H3,(H,17,18).
What are the key properties of 4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine?
4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine has a molecular weight of 267.34 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine is sourced from PubChem (CID 106573444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).