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

C13H23N3 — CID 106580216

IUPACN-(2-cyclopropylpropyl)-1-(2-methylpropyl)imidazol-2-amine
SMILESCC(C)Cn1ccnc1NCC(C)C1CC1
InChIInChI=1S/C13H23N3/c1-10(2)9-16-7-6-14-13(16)15-8-11(3)12-4-5-12/h6-7,10-12H,4-5,8-9H2,1-3H3,(H,14,15)
InChIKeyQJYMSPQQOSQDMR-UHFFFAOYSA-N
MW221.35 g/mol
LogP3.00
Rot. Bonds6

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

N-(2-cyclopropylpropyl)-1-(2-methylpropyl)imidazol-2-amine (PubChem CID 106580216) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is N-(2-cyclopropylpropyl)-1-(2-methylpropyl)imidazol-2-amine.

Molecular Properties

Compound NameN-(2-cyclopropylpropyl)-1-(2-methylpropyl)imidazol-2-amine
PubChem CID106580216
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC NameN-(2-cyclopropylpropyl)-1-(2-methylpropyl)imidazol-2-amine
SMILESCC(C)Cn1ccnc1NCC(C)C1CC1
InChIInChI=1S/C13H23N3/c1-10(2)9-16-7-6-14-13(16)15-8-11(3)12-4-5-12/h6-7,10-12H,4-5,8-9H2,1-3H3,(H,14,15)
InChIKeyQJYMSPQQOSQDMR-UHFFFAOYSA-N
XLogP3.00
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 ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropylpropyl)-1-(2-methylpropyl)imidazol-2-amine?
The IUPAC name of N-(2-cyclopropylpropyl)-1-(2-methylpropyl)imidazol-2-amine (CID 106580216) is N-(2-cyclopropylpropyl)-1-(2-methylpropyl)imidazol-2-amine.
What is the SMILES notation for N-(2-cyclopropylpropyl)-1-(2-methylpropyl)imidazol-2-amine?
The canonical SMILES for N-(2-cyclopropylpropyl)-1-(2-methylpropyl)imidazol-2-amine is CC(C)Cn1ccnc1NCC(C)C1CC1.
What is the InChIKey of N-(2-cyclopropylpropyl)-1-(2-methylpropyl)imidazol-2-amine?
The InChIKey is QJYMSPQQOSQDMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-10(2)9-16-7-6-14-13(16)15-8-11(3)12-4-5-12/h6-7,10-12H,4-5,8-9H2,1-3H3,(H,14,15).
What are the key properties of N-(2-cyclopropylpropyl)-1-(2-methylpropyl)imidazol-2-amine?
N-(2-cyclopropylpropyl)-1-(2-methylpropyl)imidazol-2-amine has a molecular weight of 221.35 g/mol, XLogP of 3.00, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropylpropyl)-1-(2-methylpropyl)imidazol-2-amine is sourced from PubChem (CID 106580216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).