N-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine

C15H23N5 — CID 106579652

IUPACN-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine
SMILESCc1cn(CCCn2cccn2)c(NC2CCCC2)n1
InChIInChI=1S/C15H23N5/c1-13-12-19(9-5-11-20-10-4-8-16-20)15(17-13)18-14-6-2-3-7-14/h4,8,10,12,14H,2-3,5-7,9,11H2,1H3,(H,17,18)
InChIKeyCLNCKUDOJGNPOW-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.83
Rot. Bonds6

About N-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine

N-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine (PubChem CID 106579652) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is N-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine.

Molecular Properties

Compound NameN-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine
PubChem CID106579652
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC NameN-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine
SMILESCc1cn(CCCn2cccn2)c(NC2CCCC2)n1
InChIInChI=1S/C15H23N5/c1-13-12-19(9-5-11-20-10-4-8-16-20)15(17-13)18-14-6-2-3-7-14/h4,8,10,12,14H,2-3,5-7,9,11H2,1H3,(H,17,18)
InChIKeyCLNCKUDOJGNPOW-UHFFFAOYSA-N
XLogP2.83
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine?
The IUPAC name of N-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine (CID 106579652) is N-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine.
What is the SMILES notation for N-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine?
The canonical SMILES for N-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine is Cc1cn(CCCn2cccn2)c(NC2CCCC2)n1.
What is the InChIKey of N-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine?
The InChIKey is CLNCKUDOJGNPOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-13-12-19(9-5-11-20-10-4-8-16-20)15(17-13)18-14-6-2-3-7-14/h4,8,10,12,14H,2-3,5-7,9,11H2,1H3,(H,17,18).
What are the key properties of N-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine?
N-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine has a molecular weight of 273.38 g/mol, XLogP of 2.83, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine is sourced from PubChem (CID 106579652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).