5-(5-chloro-1-propylbenzimidazol-2-yl)-1H-pyrazol-3-amine

C13H14ClN5 — CID 64528085

IUPAC5-(5-chloro-1-propylbenzimidazol-2-yl)-1H-pyrazol-3-amine
SMILESCCCn1c(-c2cc(N)n[nH]2)nc2cc(Cl)ccc21
InChIInChI=1S/C13H14ClN5/c1-2-5-19-11-4-3-8(14)6-9(11)16-13(19)10-7-12(15)18-17-10/h3-4,6-7H,2,5H2,1H3,(H3,15,17,18)
InChIKeyDPEDHGIYOCUBDQ-UHFFFAOYSA-N
MW275.74 g/mol
LogP3.07
Rot. Bonds3

About 5-(5-chloro-1-propylbenzimidazol-2-yl)-1H-pyrazol-3-amine

5-(5-chloro-1-propylbenzimidazol-2-yl)-1H-pyrazol-3-amine (PubChem CID 64528085) has the molecular formula C13H14ClN5 and a molecular weight of 275.74 g/mol. Its IUPAC name is 5-(5-chloro-1-propylbenzimidazol-2-yl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(5-chloro-1-propylbenzimidazol-2-yl)-1H-pyrazol-3-amine
PubChem CID64528085
Molecular FormulaC13H14ClN5
Molecular Weight275.74 g/mol
Exact Mass275.09
IUPAC Name5-(5-chloro-1-propylbenzimidazol-2-yl)-1H-pyrazol-3-amine
SMILESCCCn1c(-c2cc(N)n[nH]2)nc2cc(Cl)ccc21
InChIInChI=1S/C13H14ClN5/c1-2-5-19-11-4-3-8(14)6-9(11)16-13(19)10-7-12(15)18-17-10/h3-4,6-7H,2,5H2,1H3,(H3,15,17,18)
InChIKeyDPEDHGIYOCUBDQ-UHFFFAOYSA-N
XLogP3.07
TPSA72.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(5-chloro-1-propylbenzimidazol-2-yl)-1H-pyrazol-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-chloro-2-methyl-1-propylbenzimidazole
CID 46310722
3-chloro-2-(5-chloro-1-propylbenzimidazol-2-yl)aniline
CID 63724804
3-(5-chloro-1-propylbenzimidazol-2-yl)thiophen-2-amine
CID 60784251
3-(5-chloro-1-propylbenzimidazol-2-yl)-2-methylaniline
CID 62946902
5-(5-chloro-1-methylbenzimidazol-2-yl)-1H-1,2,4-triazol-3-amine
CID 62807862
5-chloro-2-ethyl-1-propylbenzimidazole
CID 46310723
3-(5-chloro-1-propylbenzimidazol-2-yl)-2-methylphenol
CID 82810464
2-(5-chloro-1-propylbenzimidazol-2-yl)-2-ethylbutan-1-amine
CID 115430234
1-(5-chloro-1-propylbenzimidazol-2-yl)-1-cyclopropylethanamine
CID 64669272
2-butan-2-yl-5-chloro-1-propylbenzimidazole
CID 46310727
5-chloro-2-(piperidin-4-ylmethyl)-1-propylbenzimidazole
CID 79615143
2-chloro-5-(5-methyl-1-propylbenzimidazol-2-yl)aniline
CID 60785145

Frequently Asked Questions

What is the IUPAC name of 5-(5-chloro-1-propylbenzimidazol-2-yl)-1H-pyrazol-3-amine?
The IUPAC name of 5-(5-chloro-1-propylbenzimidazol-2-yl)-1H-pyrazol-3-amine (CID 64528085) is 5-(5-chloro-1-propylbenzimidazol-2-yl)-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(5-chloro-1-propylbenzimidazol-2-yl)-1H-pyrazol-3-amine?
The canonical SMILES for 5-(5-chloro-1-propylbenzimidazol-2-yl)-1H-pyrazol-3-amine is CCCn1c(-c2cc(N)n[nH]2)nc2cc(Cl)ccc21.
What is the InChIKey of 5-(5-chloro-1-propylbenzimidazol-2-yl)-1H-pyrazol-3-amine?
The InChIKey is DPEDHGIYOCUBDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClN5/c1-2-5-19-11-4-3-8(14)6-9(11)16-13(19)10-7-12(15)18-17-10/h3-4,6-7H,2,5H2,1H3,(H3,15,17,18).
What are the key properties of 5-(5-chloro-1-propylbenzimidazol-2-yl)-1H-pyrazol-3-amine?
5-(5-chloro-1-propylbenzimidazol-2-yl)-1H-pyrazol-3-amine has a molecular weight of 275.74 g/mol, XLogP of 3.07, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-chloro-1-propylbenzimidazol-2-yl)-1H-pyrazol-3-amine is sourced from PubChem (CID 64528085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).