N-(2,3-dihydro-1H-indol-5-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide

C14H16N4O — CID 63253113

IUPACN-(2,3-dihydro-1H-indol-5-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
SMILESCc1n[nH]c(C)c1C(=O)Nc1ccc2c(c1)CCN2
InChIInChI=1S/C14H16N4O/c1-8-13(9(2)18-17-8)14(19)16-11-3-4-12-10(7-11)5-6-15-12/h3-4,7,15H,5-6H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyYVPMNORIDVYOQE-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.25
Rot. Bonds2

About N-(2,3-dihydro-1H-indol-5-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide

N-(2,3-dihydro-1H-indol-5-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide (PubChem CID 63253113) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-indol-5-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-indol-5-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
PubChem CID63253113
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC NameN-(2,3-dihydro-1H-indol-5-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
SMILESCc1n[nH]c(C)c1C(=O)Nc1ccc2c(c1)CCN2
InChIInChI=1S/C14H16N4O/c1-8-13(9(2)18-17-8)14(19)16-11-3-4-12-10(7-11)5-6-15-12/h3-4,7,15H,5-6H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyYVPMNORIDVYOQE-UHFFFAOYSA-N
XLogP2.25
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dihydro-1H-indol-5-yl)-2,4,5-trimethylfuran-3-carboxamide
CID 65153310
N-(2,3-dihydro-1H-indol-5-yl)-5-methyl-1,2-oxazole-3-carboxamide
CID 55168760
N-(4-bromo-3-methylphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 43582476
3,5-dimethyl-N-(4-propan-2-yloxyphenyl)-1H-pyrazole-4-carboxamide
CID 43583048
N-(2,3-dihydro-1H-indol-5-yl)-2,4-dimethylbenzamide
CID 63252782
N-(4-acetamido-3-methylphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 61274560
N-(3,4-dimethoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 43582479
5-bromo-N-(2,3-dihydro-1H-indol-5-yl)-2-methylbenzamide
CID 65312010
N-(2,3-dihydro-1H-indol-5-yl)-2-fluoro-5-methylbenzamide
CID 63252982
2-bromo-N-(2,3-dihydro-1H-indol-5-yl)-5-methylbenzamide
CID 81112809
N-(3-fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 43582601
N-(2,3-dihydro-1H-indol-5-yl)-4-iodobenzamide
CID 63252905

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-indol-5-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide?
The IUPAC name of N-(2,3-dihydro-1H-indol-5-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide (CID 63253113) is N-(2,3-dihydro-1H-indol-5-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-(2,3-dihydro-1H-indol-5-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-(2,3-dihydro-1H-indol-5-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide is Cc1n[nH]c(C)c1C(=O)Nc1ccc2c(c1)CCN2.
What is the InChIKey of N-(2,3-dihydro-1H-indol-5-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide?
The InChIKey is YVPMNORIDVYOQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c1-8-13(9(2)18-17-8)14(19)16-11-3-4-12-10(7-11)5-6-15-12/h3-4,7,15H,5-6H2,1-2H3,(H,16,19)(H,17,18).
What are the key properties of N-(2,3-dihydro-1H-indol-5-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide?
N-(2,3-dihydro-1H-indol-5-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide has a molecular weight of 256.31 g/mol, XLogP of 2.25, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-indol-5-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 63253113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).