N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-piperidin-1-ylacetamide

C19H24N6O — CID 135804579

IUPACN-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-piperidin-1-ylacetamide
SMILESCc1cc2nc(-c3[nH]ncc3NC(=O)CN3CCCCC3)[nH]c2cc1C
InChIInChI=1S/C19H24N6O/c1-12-8-14-15(9-13(12)2)23-19(22-14)18-16(10-20-24-18)21-17(26)11-25-6-4-3-5-7-25/h8-10H,3-7,11H2,1-2H3,(H,20,24)(H,21,26)(H,22,23)
InChIKeyAQHCXZORIWXIGW-UHFFFAOYSA-N
MW352.44 g/mol
LogP2.99
Rot. Bonds4

About N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-piperidin-1-ylacetamide

N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-piperidin-1-ylacetamide (PubChem CID 135804579) has the molecular formula C19H24N6O and a molecular weight of 352.44 g/mol. Its IUPAC name is N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-piperidin-1-ylacetamide.

Molecular Properties

Compound NameN-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-piperidin-1-ylacetamide
PubChem CID135804579
Molecular FormulaC19H24N6O
Molecular Weight352.44 g/mol
Exact Mass352.20
IUPAC NameN-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-piperidin-1-ylacetamide
SMILESCc1cc2nc(-c3[nH]ncc3NC(=O)CN3CCCCC3)[nH]c2cc1C
InChIInChI=1S/C19H24N6O/c1-12-8-14-15(9-13(12)2)23-19(22-14)18-16(10-20-24-18)21-17(26)11-25-6-4-3-5-7-25/h8-10H,3-7,11H2,1-2H3,(H,20,24)(H,21,26)(H,22,23)
InChIKeyAQHCXZORIWXIGW-UHFFFAOYSA-N
XLogP2.99
TPSA89.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 52.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]cyclopenta-1,4-diene-1-carboxamide
CID 136608966
N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]piperidine-1-carboxamide
CID 136609014
4-methyl-N-[5-(3,5,6,7-tetrahydrocyclopenta[f]benzimidazol-2-yl)-1H-pyrazol-4-yl]piperazine-1-carboxamide
CID 135750711
N-(1H-indazol-6-yl)-2-piperidin-1-ylacetamide
CID 4205198
N-(2,5-dimethylphenyl)-2-pyrrolidin-1-ylacetamide
CID 8901854
N-[5-(5-ethyl-7,7-dimethyl-6-oxo-1H-pyrrolo[2,3-f]benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methylbutanamide
CID 135501813
2-(4-ethylpiperazin-1-yl)-N-[2-(4-methylphenyl)-3H-benzimidazol-5-yl]acetamide
CID 56673048
2-(azepan-1-yl)-N-(3,4-dimethylphenyl)acetamide
CID 8895959
5,6-dimethyl-2-(piperidin-1-ylsulfonylmethyl)-1H-benzimidazole
CID 10852265
N-(2,5-dimethoxyphenyl)-2-[4-(5,6-dimethyl-1H-benzimidazol-2-yl)piperidin-1-yl]acetamide
CID 1453138
2-methoxy-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-5-pyrrolidin-1-ylsulfanylbenzamide
CID 136501304
N-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]-2-(3-hydroxypiperidin-1-yl)acetamide
CID 86287334

Frequently Asked Questions

What is the IUPAC name of N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-piperidin-1-ylacetamide?
The IUPAC name of N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-piperidin-1-ylacetamide (CID 135804579) is N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-piperidin-1-ylacetamide.
What is the SMILES notation for N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-piperidin-1-ylacetamide?
The canonical SMILES for N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-piperidin-1-ylacetamide is Cc1cc2nc(-c3[nH]ncc3NC(=O)CN3CCCCC3)[nH]c2cc1C.
What is the InChIKey of N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-piperidin-1-ylacetamide?
The InChIKey is AQHCXZORIWXIGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N6O/c1-12-8-14-15(9-13(12)2)23-19(22-14)18-16(10-20-24-18)21-17(26)11-25-6-4-3-5-7-25/h8-10H,3-7,11H2,1-2H3,(H,20,24)(H,21,26)(H,22,23).
What are the key properties of N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-piperidin-1-ylacetamide?
N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-piperidin-1-ylacetamide has a molecular weight of 352.44 g/mol, XLogP of 2.99, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-piperidin-1-ylacetamide is sourced from PubChem (CID 135804579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).