N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indole-5-carboxamide

C14H16N4O — CID 104618763

IUPACN-(4,5-dimethyl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indole-5-carboxamide
SMILESCc1[nH]nc(NC(=O)c2ccc3c(c2)CCN3)c1C
InChIInChI=1S/C14H16N4O/c1-8-9(2)17-18-13(8)16-14(19)11-3-4-12-10(7-11)5-6-15-12/h3-4,7,15H,5-6H2,1-2H3,(H2,16,17,18,19)
InChIKeyASECEFSVIADALE-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.25
Rot. Bonds2

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

N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indole-5-carboxamide (PubChem CID 104618763) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indole-5-carboxamide
PubChem CID104618763
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indole-5-carboxamide
SMILESCc1[nH]nc(NC(=O)c2ccc3c(c2)CCN3)c1C
InChIInChI=1S/C14H16N4O/c1-8-9(2)17-18-13(8)16-14(19)11-3-4-12-10(7-11)5-6-15-12/h3-4,7,15H,5-6H2,1-2H3,(H2,16,17,18,19)
InChIKeyASECEFSVIADALE-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-(4,5-dimethyl-1H-pyrazol-3-yl)-3,4-dimethylbenzamide
CID 112687360
3-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-methylbenzamide
CID 104616482
N-(4-methyl-1H-pyrazol-5-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 104618997
N-(5-methyl-1,2-oxazol-3-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43142437
N-pyrimidin-2-yl-2,3-dihydro-1H-indole-5-carboxamide
CID 43142516
N-(4,6-dimethyl-2-pyridinyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 114932174
N-(2,5-dimethylpyrazol-3-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43325652
3-bromo-N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-methylbenzamide
CID 112696158
N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylbenzamide
CID 113227581
N-(3-bromo-2-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 104938285
N-(3-bromo-4-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 63334695
N-(3-bromo-5-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 107583383

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indole-5-carboxamide?
The IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indole-5-carboxamide (CID 104618763) is N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indole-5-carboxamide.
What is the SMILES notation for N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indole-5-carboxamide?
The canonical SMILES for N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indole-5-carboxamide is Cc1[nH]nc(NC(=O)c2ccc3c(c2)CCN3)c1C.
What is the InChIKey of N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indole-5-carboxamide?
The InChIKey is ASECEFSVIADALE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c1-8-9(2)17-18-13(8)16-14(19)11-3-4-12-10(7-11)5-6-15-12/h3-4,7,15H,5-6H2,1-2H3,(H2,16,17,18,19).
What are the key properties of N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indole-5-carboxamide?
N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indole-5-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-(4,5-dimethyl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indole-5-carboxamide is sourced from PubChem (CID 104618763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).