1-(1-cyclopropylpropan-2-yl)-4-methyl-N-propylimidazol-2-amine

C13H23N3 — CID 106572732

IUPAC1-(1-cyclopropylpropan-2-yl)-4-methyl-N-propylimidazol-2-amine
SMILESCCCNc1nc(C)cn1C(C)CC1CC1
InChIInChI=1S/C13H23N3/c1-4-7-14-13-15-10(2)9-16(13)11(3)8-12-5-6-12/h9,11-12H,4-8H2,1-3H3,(H,14,15)
InChIKeyRAPMCDMXMLVTCD-UHFFFAOYSA-N
MW221.35 g/mol
LogP3.37
Rot. Bonds6

About 1-(1-cyclopropylpropan-2-yl)-4-methyl-N-propylimidazol-2-amine

1-(1-cyclopropylpropan-2-yl)-4-methyl-N-propylimidazol-2-amine (PubChem CID 106572732) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 1-(1-cyclopropylpropan-2-yl)-4-methyl-N-propylimidazol-2-amine.

Molecular Properties

Compound Name1-(1-cyclopropylpropan-2-yl)-4-methyl-N-propylimidazol-2-amine
PubChem CID106572732
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name1-(1-cyclopropylpropan-2-yl)-4-methyl-N-propylimidazol-2-amine
SMILESCCCNc1nc(C)cn1C(C)CC1CC1
InChIInChI=1S/C13H23N3/c1-4-7-14-13-15-10(2)9-16(13)11(3)8-12-5-6-12/h9,11-12H,4-8H2,1-3H3,(H,14,15)
InChIKeyRAPMCDMXMLVTCD-UHFFFAOYSA-N
XLogP3.37
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-cyclobutylethyl)-4-methyl-N-propylimidazol-2-amine
CID 106582706
1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine
CID 106554728
N-cyclohexyl-1-(1-cyclopropylpropan-2-yl)-4-methylimidazol-2-amine
CID 106572754
4-methyl-1-[1-(oxolan-2-yl)ethyl]-N-propylimidazol-2-amine
CID 106562062
1-butan-2-yl-N-ethyl-4-methylimidazol-2-amine
CID 106554895
N-(1-cyclopropylbutan-2-yl)-4-methyl-1-propan-2-ylimidazol-2-amine
CID 106573533
1-butan-2-yl-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106554900
N-butyl-1-(1-ethylsulfanylpropan-2-yl)-4-methylimidazol-2-amine
CID 106582178
4-methyl-1-pentan-2-yl-N-prop-2-enylimidazol-2-amine
CID 106555821
N-cyclopropyl-1-(1-cyclopropylbutan-2-yl)-4-methylimidazol-2-amine
CID 106573549
1-hexan-2-yl-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106569745
1-cyclooctyl-4-methyl-N-propylimidazol-2-amine
CID 106557157

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopropylpropan-2-yl)-4-methyl-N-propylimidazol-2-amine?
The IUPAC name of 1-(1-cyclopropylpropan-2-yl)-4-methyl-N-propylimidazol-2-amine (CID 106572732) is 1-(1-cyclopropylpropan-2-yl)-4-methyl-N-propylimidazol-2-amine.
What is the SMILES notation for 1-(1-cyclopropylpropan-2-yl)-4-methyl-N-propylimidazol-2-amine?
The canonical SMILES for 1-(1-cyclopropylpropan-2-yl)-4-methyl-N-propylimidazol-2-amine is CCCNc1nc(C)cn1C(C)CC1CC1.
What is the InChIKey of 1-(1-cyclopropylpropan-2-yl)-4-methyl-N-propylimidazol-2-amine?
The InChIKey is RAPMCDMXMLVTCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-4-7-14-13-15-10(2)9-16(13)11(3)8-12-5-6-12/h9,11-12H,4-8H2,1-3H3,(H,14,15).
What are the key properties of 1-(1-cyclopropylpropan-2-yl)-4-methyl-N-propylimidazol-2-amine?
1-(1-cyclopropylpropan-2-yl)-4-methyl-N-propylimidazol-2-amine has a molecular weight of 221.35 g/mol, XLogP of 3.37, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropylpropan-2-yl)-4-methyl-N-propylimidazol-2-amine is sourced from PubChem (CID 106572732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).