N-pyridin-3-yl-2,3-dihydro-1H-indole-5-carboxamide

C14H13N3O — CID 43142430

IUPACN-pyridin-3-yl-2,3-dihydro-1H-indole-5-carboxamide
SMILESO=C(Nc1cccnc1)c1ccc2c(c1)CCN2
InChIInChI=1S/C14H13N3O/c18-14(17-12-2-1-6-15-9-12)11-3-4-13-10(8-11)5-7-16-13/h1-4,6,8-9,16H,5,7H2,(H,17,18)
InChIKeyNYDCDCNRJBUMGQ-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.30
Rot. Bonds2

About N-pyridin-3-yl-2,3-dihydro-1H-indole-5-carboxamide

N-pyridin-3-yl-2,3-dihydro-1H-indole-5-carboxamide (PubChem CID 43142430) has the molecular formula C14H13N3O and a molecular weight of 239.28 g/mol. Its IUPAC name is N-pyridin-3-yl-2,3-dihydro-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-pyridin-3-yl-2,3-dihydro-1H-indole-5-carboxamide
PubChem CID43142430
Molecular FormulaC14H13N3O
Molecular Weight239.28 g/mol
Exact Mass239.11
IUPAC NameN-pyridin-3-yl-2,3-dihydro-1H-indole-5-carboxamide
SMILESO=C(Nc1cccnc1)c1ccc2c(c1)CCN2
InChIInChI=1S/C14H13N3O/c18-14(17-12-2-1-6-15-9-12)11-3-4-13-10(8-11)5-7-16-13/h1-4,6,8-9,16H,5,7H2,(H,17,18)
InChIKeyNYDCDCNRJBUMGQ-UHFFFAOYSA-N
XLogP2.30
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-pyridin-3-yl-2,3-dihydro-1H-indole-5-carboxamide?
The IUPAC name of N-pyridin-3-yl-2,3-dihydro-1H-indole-5-carboxamide (CID 43142430) is N-pyridin-3-yl-2,3-dihydro-1H-indole-5-carboxamide.
What is the SMILES notation for N-pyridin-3-yl-2,3-dihydro-1H-indole-5-carboxamide?
The canonical SMILES for N-pyridin-3-yl-2,3-dihydro-1H-indole-5-carboxamide is O=C(Nc1cccnc1)c1ccc2c(c1)CCN2.
What is the InChIKey of N-pyridin-3-yl-2,3-dihydro-1H-indole-5-carboxamide?
The InChIKey is NYDCDCNRJBUMGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O/c18-14(17-12-2-1-6-15-9-12)11-3-4-13-10(8-11)5-7-16-13/h1-4,6,8-9,16H,5,7H2,(H,17,18).
What are the key properties of N-pyridin-3-yl-2,3-dihydro-1H-indole-5-carboxamide?
N-pyridin-3-yl-2,3-dihydro-1H-indole-5-carboxamide has a molecular weight of 239.28 g/mol, XLogP of 2.30, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridin-3-yl-2,3-dihydro-1H-indole-5-carboxamide is sourced from PubChem (CID 43142430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).