4-methyl-N-phenyl-1-(2-propan-2-yloxyethyl)imidazol-2-amine

C15H21N3O — CID 106581590

IUPAC4-methyl-N-phenyl-1-(2-propan-2-yloxyethyl)imidazol-2-amine
SMILESCc1cn(CCOC(C)C)c(Nc2ccccc2)n1
InChIInChI=1S/C15H21N3O/c1-12(2)19-10-9-18-11-13(3)16-15(18)17-14-7-5-4-6-8-14/h4-8,11-12H,9-10H2,1-3H3,(H,16,17)
InChIKeySQDHPESGWHNDQJ-UHFFFAOYSA-N
MW259.35 g/mol
LogP3.36
Rot. Bonds6

About 4-methyl-N-phenyl-1-(2-propan-2-yloxyethyl)imidazol-2-amine

4-methyl-N-phenyl-1-(2-propan-2-yloxyethyl)imidazol-2-amine (PubChem CID 106581590) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 4-methyl-N-phenyl-1-(2-propan-2-yloxyethyl)imidazol-2-amine.

Molecular Properties

Compound Name4-methyl-N-phenyl-1-(2-propan-2-yloxyethyl)imidazol-2-amine
PubChem CID106581590
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name4-methyl-N-phenyl-1-(2-propan-2-yloxyethyl)imidazol-2-amine
SMILESCc1cn(CCOC(C)C)c(Nc2ccccc2)n1
InChIInChI=1S/C15H21N3O/c1-12(2)19-10-9-18-11-13(3)16-15(18)17-14-7-5-4-6-8-14/h4-8,11-12H,9-10H2,1-3H3,(H,16,17)
InChIKeySQDHPESGWHNDQJ-UHFFFAOYSA-N
XLogP3.36
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1H-imidazol-4-ylmethyl)aniline
CID 13178307
4-(2-(Phenylamino)ethyl)-1H-imidazole
CID 46222042
Ethyl-(3H-imidazol-4-ylmethyl)-phenyl-amine
CID 24946957
N-(1H-imidazol-5-ylmethyl)-N-methylaniline
CID 24946958
N-(1H-imidazol-5-ylmethyl)-N-propan-2-ylaniline
CID 24946961
2-[4-(Morpholino)anilino]-4-(1-isopropyl-2-methyl-1h-imidazol-5-yl)pyrimidine
CID 44578651
1-Phenyl-1H-imidazol-2-amine
CID 13805405
1-(2-Methoxy-ethyl)-5-phenyl-1H-imidazol-2-ylamine
CID 3160437
Imidazole, 1-(1-phenylethyl)-5-(morpholinomethyl)-
CID 299413
Imidazole, 5-methyl-1-phenyl-2-(pyrrolidinyl)-
CID 3044985
(1-phenyl-1H-imidazol-2-yl)methanol
CID 277166
4-(4,5-dimethyl-1H-imidazol-1-yl)aniline
CID 62351058

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-phenyl-1-(2-propan-2-yloxyethyl)imidazol-2-amine?
The IUPAC name of 4-methyl-N-phenyl-1-(2-propan-2-yloxyethyl)imidazol-2-amine (CID 106581590) is 4-methyl-N-phenyl-1-(2-propan-2-yloxyethyl)imidazol-2-amine.
What is the SMILES notation for 4-methyl-N-phenyl-1-(2-propan-2-yloxyethyl)imidazol-2-amine?
The canonical SMILES for 4-methyl-N-phenyl-1-(2-propan-2-yloxyethyl)imidazol-2-amine is Cc1cn(CCOC(C)C)c(Nc2ccccc2)n1.
What is the InChIKey of 4-methyl-N-phenyl-1-(2-propan-2-yloxyethyl)imidazol-2-amine?
The InChIKey is SQDHPESGWHNDQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-12(2)19-10-9-18-11-13(3)16-15(18)17-14-7-5-4-6-8-14/h4-8,11-12H,9-10H2,1-3H3,(H,16,17).
What are the key properties of 4-methyl-N-phenyl-1-(2-propan-2-yloxyethyl)imidazol-2-amine?
4-methyl-N-phenyl-1-(2-propan-2-yloxyethyl)imidazol-2-amine has a molecular weight of 259.35 g/mol, XLogP of 3.36, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-phenyl-1-(2-propan-2-yloxyethyl)imidazol-2-amine is sourced from PubChem (CID 106581590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).