4-methyl-1-(3-phenylbutyl)-N-propylimidazol-2-amine

C17H25N3 — CID 106572132

IUPAC4-methyl-1-(3-phenylbutyl)-N-propylimidazol-2-amine
SMILESCCCNc1nc(C)cn1CCC(C)c1ccccc1
InChIInChI=1S/C17H25N3/c1-4-11-18-17-19-15(3)13-20(17)12-10-14(2)16-8-6-5-7-9-16/h5-9,13-14H,4,10-12H2,1-3H3,(H,18,19)
InChIKeyLXPZVEQDYVDJSD-UHFFFAOYSA-N
MW271.41 g/mol
LogP4.21
Rot. Bonds7

About 4-methyl-1-(3-phenylbutyl)-N-propylimidazol-2-amine

4-methyl-1-(3-phenylbutyl)-N-propylimidazol-2-amine (PubChem CID 106572132) has the molecular formula C17H25N3 and a molecular weight of 271.41 g/mol. Its IUPAC name is 4-methyl-1-(3-phenylbutyl)-N-propylimidazol-2-amine.

Molecular Properties

Compound Name4-methyl-1-(3-phenylbutyl)-N-propylimidazol-2-amine
PubChem CID106572132
Molecular FormulaC17H25N3
Molecular Weight271.41 g/mol
Exact Mass271.20
IUPAC Name4-methyl-1-(3-phenylbutyl)-N-propylimidazol-2-amine
SMILESCCCNc1nc(C)cn1CCC(C)c1ccccc1
InChIInChI=1S/C17H25N3/c1-4-11-18-17-19-15(3)13-20(17)12-10-14(2)16-8-6-5-7-9-16/h5-9,13-14H,4,10-12H2,1-3H3,(H,18,19)
InChIKeyLXPZVEQDYVDJSD-UHFFFAOYSA-N
XLogP4.21
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.41
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-1-(3-methylbutyl)-N-propylimidazol-2-amine
CID 106557292
4-methyl-1-(2-methylpropyl)-N-(3-phenylbutyl)imidazol-2-amine
CID 106572129
N-butyl-4-methyl-1-(3-methylbutyl)imidazol-2-amine
CID 106557291
4-methyl-1-(naphthalen-1-ylmethyl)-N-propylimidazol-2-amine
CID 106571366
4-methyl-N-propyl-1-(2-pyridin-4-ylethyl)imidazol-2-amine
CID 106563289
2-[4-methyl-1-(3-phenylbutyl)imidazol-2-yl]sulfanylacetic acid
CID 81344281
1-ethyl-4-methyl-N-(3-methylbutyl)imidazol-2-amine
CID 106557328
4-methyl-N-propyl-1-(5,5,5-trifluoropentyl)imidazol-2-amine
CID 106579279
N-ethyl-1-(3-phenylbutyl)imidazol-2-amine
CID 106572158
1-butyl-4-methyl-N-octylimidazol-2-amine
CID 106578853
4-methyl-N-(1-phenylpropan-2-yl)-1-propylimidazol-2-amine
CID 106571864
N-[[3-(3-phenylbutyl)imidazol-4-yl]methyl]propan-1-amine
CID 66152003

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(3-phenylbutyl)-N-propylimidazol-2-amine?
The IUPAC name of 4-methyl-1-(3-phenylbutyl)-N-propylimidazol-2-amine (CID 106572132) is 4-methyl-1-(3-phenylbutyl)-N-propylimidazol-2-amine.
What is the SMILES notation for 4-methyl-1-(3-phenylbutyl)-N-propylimidazol-2-amine?
The canonical SMILES for 4-methyl-1-(3-phenylbutyl)-N-propylimidazol-2-amine is CCCNc1nc(C)cn1CCC(C)c1ccccc1.
What is the InChIKey of 4-methyl-1-(3-phenylbutyl)-N-propylimidazol-2-amine?
The InChIKey is LXPZVEQDYVDJSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3/c1-4-11-18-17-19-15(3)13-20(17)12-10-14(2)16-8-6-5-7-9-16/h5-9,13-14H,4,10-12H2,1-3H3,(H,18,19).
What are the key properties of 4-methyl-1-(3-phenylbutyl)-N-propylimidazol-2-amine?
4-methyl-1-(3-phenylbutyl)-N-propylimidazol-2-amine has a molecular weight of 271.41 g/mol, XLogP of 4.21, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(3-phenylbutyl)-N-propylimidazol-2-amine is sourced from PubChem (CID 106572132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).