N-(1-pyridin-2-ylpyrrolidin-3-yl)-1H-indole-3-carboxamide

C18H18N4O — CID 90621383

IUPACN-(1-pyridin-2-ylpyrrolidin-3-yl)-1H-indole-3-carboxamide
SMILESO=C(NC1CCN(c2ccccn2)C1)c1c[nH]c2ccccc12
InChIInChI=1S/C18H18N4O/c23-18(15-11-20-16-6-2-1-5-14(15)16)21-13-8-10-22(12-13)17-7-3-4-9-19-17/h1-7,9,11,13,20H,8,10,12H2,(H,21,23)
InChIKeyGFWGREBHZQWMHP-UHFFFAOYSA-N
MW306.37 g/mol
LogP2.57
Rot. Bonds3

About N-(1-pyridin-2-ylpyrrolidin-3-yl)-1H-indole-3-carboxamide

N-(1-pyridin-2-ylpyrrolidin-3-yl)-1H-indole-3-carboxamide (PubChem CID 90621383) has the molecular formula C18H18N4O and a molecular weight of 306.37 g/mol. Its IUPAC name is N-(1-pyridin-2-ylpyrrolidin-3-yl)-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-(1-pyridin-2-ylpyrrolidin-3-yl)-1H-indole-3-carboxamide
PubChem CID90621383
Molecular FormulaC18H18N4O
Molecular Weight306.37 g/mol
Exact Mass306.15
IUPAC NameN-(1-pyridin-2-ylpyrrolidin-3-yl)-1H-indole-3-carboxamide
SMILESO=C(NC1CCN(c2ccccn2)C1)c1c[nH]c2ccccc12
InChIInChI=1S/C18H18N4O/c23-18(15-11-20-16-6-2-1-5-14(15)16)21-13-8-10-22(12-13)17-7-3-4-9-19-17/h1-7,9,11,13,20H,8,10,12H2,(H,21,23)
InChIKeyGFWGREBHZQWMHP-UHFFFAOYSA-N
XLogP2.57
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(1,3-thiazol-2-yl)pyrrolidin-3-yl]-1H-indole-3-carboxamide
CID 121144787
N-[1-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrrolidin-3-yl]-1H-indole-3-carboxamide
CID 119105652
2-bromo-N-[(3R)-1-pyridin-2-ylpyrrolidin-3-yl]benzamide
CID 99696788
N-[(3R)-1-pyridin-2-ylpyrrolidin-3-yl]benzamide
CID 99697085
N-[1-[5-(hydroxycarbamoyl)-2-pyridinyl]piperidin-4-yl]-1H-indole-3-carboxamide
CID 11417616
2-methylsulfanyl-N-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]pyridine-3-carboxamide
CID 99875589
N-(1-cyclohexylpyrrolidin-3-yl)-1H-indole-3-carboxamide
CID 167818595
N-[(3R)-1-pyridin-2-ylpyrrolidin-3-yl]furan-3-carboxamide
CID 99697234
3,4-dimethyl-N-(1-pyridin-2-ylpyrrolidin-3-yl)benzamide
CID 90621378
ethane;1-methyl-3-(1-pyridin-2-ylpyrrolidin-3-yl)urea
CID 91102074
2-oxo-N-(1-pyridin-2-ylpyrrolidin-3-yl)chromene-3-carboxamide
CID 90621231
5-bromo-N-[(3R)-1-pyridin-2-ylpyrrolidin-3-yl]furan-2-carboxamide
CID 99697078

Frequently Asked Questions

What is the IUPAC name of N-(1-pyridin-2-ylpyrrolidin-3-yl)-1H-indole-3-carboxamide?
The IUPAC name of N-(1-pyridin-2-ylpyrrolidin-3-yl)-1H-indole-3-carboxamide (CID 90621383) is N-(1-pyridin-2-ylpyrrolidin-3-yl)-1H-indole-3-carboxamide.
What is the SMILES notation for N-(1-pyridin-2-ylpyrrolidin-3-yl)-1H-indole-3-carboxamide?
The canonical SMILES for N-(1-pyridin-2-ylpyrrolidin-3-yl)-1H-indole-3-carboxamide is O=C(NC1CCN(c2ccccn2)C1)c1c[nH]c2ccccc12.
What is the InChIKey of N-(1-pyridin-2-ylpyrrolidin-3-yl)-1H-indole-3-carboxamide?
The InChIKey is GFWGREBHZQWMHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O/c23-18(15-11-20-16-6-2-1-5-14(15)16)21-13-8-10-22(12-13)17-7-3-4-9-19-17/h1-7,9,11,13,20H,8,10,12H2,(H,21,23).
What are the key properties of N-(1-pyridin-2-ylpyrrolidin-3-yl)-1H-indole-3-carboxamide?
N-(1-pyridin-2-ylpyrrolidin-3-yl)-1H-indole-3-carboxamide has a molecular weight of 306.37 g/mol, XLogP of 2.57, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-pyridin-2-ylpyrrolidin-3-yl)-1H-indole-3-carboxamide is sourced from PubChem (CID 90621383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).