N-(1-cyclopentylbenzimidazol-2-yl)-3-(1-methylpyrazol-4-yl)propanamide

C19H23N5O — CID 56794904

IUPACN-(1-cyclopentylbenzimidazol-2-yl)-3-(1-methylpyrazol-4-yl)propanamide
SMILESCn1cc(CCC(=O)Nc2nc3ccccc3n2C2CCCC2)cn1
InChIInChI=1S/C19H23N5O/c1-23-13-14(12-20-23)10-11-18(25)22-19-21-16-8-4-5-9-17(16)24(19)15-6-2-3-7-15/h4-5,8-9,12-13,15H,2-3,6-7,10-11H2,1H3,(H,21,22,25)
InChIKeyFDKAEZWRZMYSFD-UHFFFAOYSA-N
MW337.43 g/mol
LogP3.46
Rot. Bonds5

About N-(1-cyclopentylbenzimidazol-2-yl)-3-(1-methylpyrazol-4-yl)propanamide

N-(1-cyclopentylbenzimidazol-2-yl)-3-(1-methylpyrazol-4-yl)propanamide (PubChem CID 56794904) has the molecular formula C19H23N5O and a molecular weight of 337.43 g/mol. Its IUPAC name is N-(1-cyclopentylbenzimidazol-2-yl)-3-(1-methylpyrazol-4-yl)propanamide.

Molecular Properties

Compound NameN-(1-cyclopentylbenzimidazol-2-yl)-3-(1-methylpyrazol-4-yl)propanamide
PubChem CID56794904
Molecular FormulaC19H23N5O
Molecular Weight337.43 g/mol
Exact Mass337.19
IUPAC NameN-(1-cyclopentylbenzimidazol-2-yl)-3-(1-methylpyrazol-4-yl)propanamide
SMILESCn1cc(CCC(=O)Nc2nc3ccccc3n2C2CCCC2)cn1
InChIInChI=1S/C19H23N5O/c1-23-13-14(12-20-23)10-11-18(25)22-19-21-16-8-4-5-9-17(16)24(19)15-6-2-3-7-15/h4-5,8-9,12-13,15H,2-3,6-7,10-11H2,1H3,(H,21,22,25)
InChIKeyFDKAEZWRZMYSFD-UHFFFAOYSA-N
XLogP3.46
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1,3-Dimethyl-7-[4-(2-methyl-imidazo[4,5-c]pyridin-1-yl)-phenyl]-4,6-dihydro-1H-pyrazolo[3,4-b][1,4]diazepin-5-one
CID 10068655
N-[4-(1H-benzimidazol-2-yl)phenyl]-1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]piperidine-3-carboxamide
CID 24818949
2-(1-methyl-1H-pyrazol-4-yl)-1H-benzimidazole
CID 16227558
N-[3-[2-[3-amino-6-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]pyrazin-2-yl]benzimidazol-1-yl]phenyl]prop-2-enamide
CID 127051445
1-Methyl-5-[4-(2-methyl-imidazo[4,5-c]pyridin-1-yl)-phenyl]-3-phenyl-6,8-dihydro-1H-pyrazolo[3,4-b][1,4]diazepin-7-one
CID 135507267
2-ethyl-N-[1-[2-(1-piperidinyl)ethyl]-2-benzimidazolyl]-3-pyrazolecarboxamide
CID 1091784
3-[(4-chloro-1H-pyrazol-1-yl)methyl]-N-(1-methyl-1H-benzimidazol-2-yl)benzamide
CID 1314911
Antihistamine-1
CID 45272895
N-(4-chlorophenyl)-2-[2-(1-methylpyrazol-4-yl)benzimidazol-1-yl]acetamide
CID 57403531
1-ethyl-3-[6-(2-ethylpyrazol-3-yl)-1H-benzimidazol-2-yl]urea
CID 71655465
US10214537, Example 8
CID 132209935
1,3-Dimethyl-5-[4-(2-methyl-imidazo[4,5-c]pyridin-1-yl)-phenyl]-6,8-dihydro-1H-pyrazolo[3,4-b][1,4]diazepin-7-one
CID 135492593

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopentylbenzimidazol-2-yl)-3-(1-methylpyrazol-4-yl)propanamide?
The IUPAC name of N-(1-cyclopentylbenzimidazol-2-yl)-3-(1-methylpyrazol-4-yl)propanamide (CID 56794904) is N-(1-cyclopentylbenzimidazol-2-yl)-3-(1-methylpyrazol-4-yl)propanamide.
What is the SMILES notation for N-(1-cyclopentylbenzimidazol-2-yl)-3-(1-methylpyrazol-4-yl)propanamide?
The canonical SMILES for N-(1-cyclopentylbenzimidazol-2-yl)-3-(1-methylpyrazol-4-yl)propanamide is Cn1cc(CCC(=O)Nc2nc3ccccc3n2C2CCCC2)cn1.
What is the InChIKey of N-(1-cyclopentylbenzimidazol-2-yl)-3-(1-methylpyrazol-4-yl)propanamide?
The InChIKey is FDKAEZWRZMYSFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O/c1-23-13-14(12-20-23)10-11-18(25)22-19-21-16-8-4-5-9-17(16)24(19)15-6-2-3-7-15/h4-5,8-9,12-13,15H,2-3,6-7,10-11H2,1H3,(H,21,22,25).
What are the key properties of N-(1-cyclopentylbenzimidazol-2-yl)-3-(1-methylpyrazol-4-yl)propanamide?
N-(1-cyclopentylbenzimidazol-2-yl)-3-(1-methylpyrazol-4-yl)propanamide has a molecular weight of 337.43 g/mol, XLogP of 3.46, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopentylbenzimidazol-2-yl)-3-(1-methylpyrazol-4-yl)propanamide is sourced from PubChem (CID 56794904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).