4-methyl-1-(1-phenylpropyl)-N-propan-2-ylimidazol-2-amine

C16H23N3 — CID 106569605

IUPAC4-methyl-1-(1-phenylpropyl)-N-propan-2-ylimidazol-2-amine
SMILESCCC(c1ccccc1)n1cc(C)nc1NC(C)C
InChIInChI=1S/C16H23N3/c1-5-15(14-9-7-6-8-10-14)19-11-13(4)18-16(19)17-12(2)3/h6-12,15H,5H2,1-4H3,(H,17,18)
InChIKeyINOZTNOFDKRVNA-UHFFFAOYSA-N
MW257.38 g/mol
LogP4.01
Rot. Bonds5

About 4-methyl-1-(1-phenylpropyl)-N-propan-2-ylimidazol-2-amine

4-methyl-1-(1-phenylpropyl)-N-propan-2-ylimidazol-2-amine (PubChem CID 106569605) has the molecular formula C16H23N3 and a molecular weight of 257.38 g/mol. Its IUPAC name is 4-methyl-1-(1-phenylpropyl)-N-propan-2-ylimidazol-2-amine.

Molecular Properties

Compound Name4-methyl-1-(1-phenylpropyl)-N-propan-2-ylimidazol-2-amine
PubChem CID106569605
Molecular FormulaC16H23N3
Molecular Weight257.38 g/mol
Exact Mass257.19
IUPAC Name4-methyl-1-(1-phenylpropyl)-N-propan-2-ylimidazol-2-amine
SMILESCCC(c1ccccc1)n1cc(C)nc1NC(C)C
InChIInChI=1S/C16H23N3/c1-5-15(14-9-7-6-8-10-14)19-11-13(4)18-16(19)17-12(2)3/h6-12,15H,5H2,1-4H3,(H,17,18)
InChIKeyINOZTNOFDKRVNA-UHFFFAOYSA-N
XLogP4.01
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-1-(1-phenylpropan-2-yl)-N-propan-2-ylimidazol-2-amine
CID 106571858
2-[4-methyl-1-(1-phenylpropyl)imidazol-2-yl]sulfanylacetic acid
CID 81336484
4-methyl-1-(1-methylsulfanylpropan-2-yl)-N-propan-2-ylimidazol-2-amine
CID 106581340
4-methyl-1-(5-methylhexan-2-yl)-N-propan-2-ylimidazol-2-amine
CID 106573765
1-(4-ethylsulfanylbutan-2-yl)-4-methyl-N-propan-2-ylimidazol-2-amine
CID 106582849
2-methyl-1-[(1S)-1-phenylpropyl]pyrrole
CID 175326097
1-butan-2-yl-N-ethyl-4-methylimidazol-2-amine
CID 106554895
4-methyl-N-propan-2-yl-1-(3-propan-2-ylphenyl)imidazol-2-amine
CID 106560995
1-(1-cyclohexylethyl)-4-methyl-N-propan-2-ylimidazol-2-amine
CID 106571270
N,4-dimethyl-1-(1-phenylpropan-2-yl)imidazol-2-amine
CID 106571835
1-(3,3-dimethylbutan-2-yl)-4-methyl-N-phenylimidazol-2-amine
CID 106580834
4-methyl-1-propan-2-yl-N-(1-thiophen-2-ylpropan-2-yl)imidazol-2-amine
CID 106573480

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(1-phenylpropyl)-N-propan-2-ylimidazol-2-amine?
The IUPAC name of 4-methyl-1-(1-phenylpropyl)-N-propan-2-ylimidazol-2-amine (CID 106569605) is 4-methyl-1-(1-phenylpropyl)-N-propan-2-ylimidazol-2-amine.
What is the SMILES notation for 4-methyl-1-(1-phenylpropyl)-N-propan-2-ylimidazol-2-amine?
The canonical SMILES for 4-methyl-1-(1-phenylpropyl)-N-propan-2-ylimidazol-2-amine is CCC(c1ccccc1)n1cc(C)nc1NC(C)C.
What is the InChIKey of 4-methyl-1-(1-phenylpropyl)-N-propan-2-ylimidazol-2-amine?
The InChIKey is INOZTNOFDKRVNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3/c1-5-15(14-9-7-6-8-10-14)19-11-13(4)18-16(19)17-12(2)3/h6-12,15H,5H2,1-4H3,(H,17,18).
What are the key properties of 4-methyl-1-(1-phenylpropyl)-N-propan-2-ylimidazol-2-amine?
4-methyl-1-(1-phenylpropyl)-N-propan-2-ylimidazol-2-amine has a molecular weight of 257.38 g/mol, XLogP of 4.01, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(1-phenylpropyl)-N-propan-2-ylimidazol-2-amine is sourced from PubChem (CID 106569605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).