1-(3-cyclopropylpropyl)-N-(2-methylpropyl)imidazol-2-amine

C13H23N3 — CID 106582547

IUPAC1-(3-cyclopropylpropyl)-N-(2-methylpropyl)imidazol-2-amine
SMILESCC(C)CNc1nccn1CCCC1CC1
InChIInChI=1S/C13H23N3/c1-11(2)10-15-13-14-7-9-16(13)8-3-4-12-5-6-12/h7,9,11-12H,3-6,8,10H2,1-2H3,(H,14,15)
InChIKeyFGAPKCREJFLZAT-UHFFFAOYSA-N
MW221.35 g/mol
LogP3.14
Rot. Bonds7

About 1-(3-cyclopropylpropyl)-N-(2-methylpropyl)imidazol-2-amine

1-(3-cyclopropylpropyl)-N-(2-methylpropyl)imidazol-2-amine (PubChem CID 106582547) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 1-(3-cyclopropylpropyl)-N-(2-methylpropyl)imidazol-2-amine.

Molecular Properties

Compound Name1-(3-cyclopropylpropyl)-N-(2-methylpropyl)imidazol-2-amine
PubChem CID106582547
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name1-(3-cyclopropylpropyl)-N-(2-methylpropyl)imidazol-2-amine
SMILESCC(C)CNc1nccn1CCCC1CC1
InChIInChI=1S/C13H23N3/c1-11(2)10-15-13-14-7-9-16(13)8-3-4-12-5-6-12/h7,9,11-12H,3-6,8,10H2,1-2H3,(H,14,15)
InChIKeyFGAPKCREJFLZAT-UHFFFAOYSA-N
XLogP3.14
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclopropylpropyl)-N-(2-methylpropyl)imidazol-2-amine?
The IUPAC name of 1-(3-cyclopropylpropyl)-N-(2-methylpropyl)imidazol-2-amine (CID 106582547) is 1-(3-cyclopropylpropyl)-N-(2-methylpropyl)imidazol-2-amine.
What is the SMILES notation for 1-(3-cyclopropylpropyl)-N-(2-methylpropyl)imidazol-2-amine?
The canonical SMILES for 1-(3-cyclopropylpropyl)-N-(2-methylpropyl)imidazol-2-amine is CC(C)CNc1nccn1CCCC1CC1.
What is the InChIKey of 1-(3-cyclopropylpropyl)-N-(2-methylpropyl)imidazol-2-amine?
The InChIKey is FGAPKCREJFLZAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-11(2)10-15-13-14-7-9-16(13)8-3-4-12-5-6-12/h7,9,11-12H,3-6,8,10H2,1-2H3,(H,14,15).
What are the key properties of 1-(3-cyclopropylpropyl)-N-(2-methylpropyl)imidazol-2-amine?
1-(3-cyclopropylpropyl)-N-(2-methylpropyl)imidazol-2-amine has a molecular weight of 221.35 g/mol, XLogP of 3.14, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopropylpropyl)-N-(2-methylpropyl)imidazol-2-amine is sourced from PubChem (CID 106582547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).