N-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-3-cyclopentylpropanamide

C19H23N5O — CID 4013933

IUPACN-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-3-cyclopentylpropanamide
SMILESCc1cc(NC(=O)CCC2CCCC2)n(-c2nc3ccccc3[nH]2)n1
InChIInChI=1S/C19H23N5O/c1-13-12-17(22-18(25)11-10-14-6-2-3-7-14)24(23-13)19-20-15-8-4-5-9-16(15)21-19/h4-5,8-9,12,14H,2-3,6-7,10-11H2,1H3,(H,20,21)(H,22,25)
InChIKeyFCPLZHFYBBFUAJ-UHFFFAOYSA-N
MW337.43 g/mol
LogP3.97
Rot. Bonds5

About N-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-3-cyclopentylpropanamide

N-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-3-cyclopentylpropanamide (PubChem CID 4013933) has the molecular formula C19H23N5O and a molecular weight of 337.43 g/mol. Its IUPAC name is N-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-3-cyclopentylpropanamide.

Molecular Properties

Compound NameN-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-3-cyclopentylpropanamide
PubChem CID4013933
Molecular FormulaC19H23N5O
Molecular Weight337.43 g/mol
Exact Mass337.19
IUPAC NameN-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-3-cyclopentylpropanamide
SMILESCc1cc(NC(=O)CCC2CCCC2)n(-c2nc3ccccc3[nH]2)n1
InChIInChI=1S/C19H23N5O/c1-13-12-17(22-18(25)11-10-14-6-2-3-7-14)24(23-13)19-20-15-8-4-5-9-16(15)21-19/h4-5,8-9,12,14H,2-3,6-7,10-11H2,1H3,(H,20,21)(H,22,25)
InChIKeyFCPLZHFYBBFUAJ-UHFFFAOYSA-N
XLogP3.97
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-3-cyclopentylpropanamide?
The IUPAC name of N-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-3-cyclopentylpropanamide (CID 4013933) is N-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-3-cyclopentylpropanamide.
What is the SMILES notation for N-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-3-cyclopentylpropanamide?
The canonical SMILES for N-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-3-cyclopentylpropanamide is Cc1cc(NC(=O)CCC2CCCC2)n(-c2nc3ccccc3[nH]2)n1.
What is the InChIKey of N-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-3-cyclopentylpropanamide?
The InChIKey is FCPLZHFYBBFUAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O/c1-13-12-17(22-18(25)11-10-14-6-2-3-7-14)24(23-13)19-20-15-8-4-5-9-16(15)21-19/h4-5,8-9,12,14H,2-3,6-7,10-11H2,1H3,(H,20,21)(H,22,25).
What are the key properties of N-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-3-cyclopentylpropanamide?
N-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-3-cyclopentylpropanamide has a molecular weight of 337.43 g/mol, XLogP of 3.97, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-3-cyclopentylpropanamide is sourced from PubChem (CID 4013933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).