1-(1H-indol-3-ylmethyl)-5-oxo-N-pyridin-2-ylpyrrolidine-2-carboxamide

C19H18N4O2 — CID 91955710

IUPAC1-(1H-indol-3-ylmethyl)-5-oxo-N-pyridin-2-ylpyrrolidine-2-carboxamide
SMILESO=C(Nc1ccccn1)C1CCC(=O)N1Cc1c[nH]c2ccccc12
InChIInChI=1S/C19H18N4O2/c24-18-9-8-16(19(25)22-17-7-3-4-10-20-17)23(18)12-13-11-21-15-6-2-1-5-14(13)15/h1-7,10-11,16,21H,8-9,12H2,(H,20,22,25)
InChIKeyPQVPQYGTKUAHJL-UHFFFAOYSA-N
MW334.38 g/mol
LogP2.69
Rot. Bonds4

About 1-(1H-indol-3-ylmethyl)-5-oxo-N-pyridin-2-ylpyrrolidine-2-carboxamide

1-(1H-indol-3-ylmethyl)-5-oxo-N-pyridin-2-ylpyrrolidine-2-carboxamide (PubChem CID 91955710) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is 1-(1H-indol-3-ylmethyl)-5-oxo-N-pyridin-2-ylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(1H-indol-3-ylmethyl)-5-oxo-N-pyridin-2-ylpyrrolidine-2-carboxamide
PubChem CID91955710
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC Name1-(1H-indol-3-ylmethyl)-5-oxo-N-pyridin-2-ylpyrrolidine-2-carboxamide
SMILESO=C(Nc1ccccn1)C1CCC(=O)N1Cc1c[nH]c2ccccc12
InChIInChI=1S/C19H18N4O2/c24-18-9-8-16(19(25)22-17-7-3-4-10-20-17)23(18)12-13-11-21-15-6-2-1-5-14(13)15/h1-7,10-11,16,21H,8-9,12H2,(H,20,22,25)
InChIKeyPQVPQYGTKUAHJL-UHFFFAOYSA-N
XLogP2.69
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-1-(1H-indol-3-ylmethyl)-5-oxopyrrolidine-2-carboxamide
CID 91955545
N-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-1-(1H-indol-3-ylmethyl)-5-oxopyrrolidine-2-carboxamide
CID 91955560
N-(1,3-benzothiazol-2-yl)-1-(1H-indol-3-ylmethyl)-5-oxopyrrolidine-2-carboxamide
CID 91955809
1-(1H-indol-3-ylmethyl)-5-oxo-N-(2-prop-2-enoxyphenyl)pyrrolidine-2-carboxamide
CID 91955679
1-(1H-indol-3-ylmethyl)-5-oxo-N-[2-(1-phenylpropyl)pyrazol-3-yl]pyrrolidine-2-carboxamide
CID 91955616
N-(3-carbamoylphenyl)-1-(1H-indol-3-ylmethyl)-5-oxopyrrolidine-2-carboxamide
CID 91955626
N-butyl-1-(1H-indol-3-ylmethyl)-5-oxopyrrolidine-2-carboxamide
CID 91955745
1-(1H-indol-3-ylmethyl)-5-oxo-N-(3-pyrrol-1-ylphenyl)pyrrolidine-2-carboxamide
CID 91955666
1-(1H-indol-3-ylmethyl)-5-(pyrrolidine-1-carbonyl)pyrrolidin-2-one
CID 91955823
N-(3-imidazol-1-ylpropyl)-1-(1H-indol-3-ylmethyl)-5-oxopyrrolidine-2-carboxamide
CID 91955799
1-(1H-indol-3-ylmethyl)-N-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-2-carboxamide
CID 91955773
N-[(1,5-dimethylpyrazol-4-yl)methyl]-1-(1H-indol-3-ylmethyl)-5-oxopyrrolidine-2-carboxamide
CID 91955596

Frequently Asked Questions

What is the IUPAC name of 1-(1H-indol-3-ylmethyl)-5-oxo-N-pyridin-2-ylpyrrolidine-2-carboxamide?
The IUPAC name of 1-(1H-indol-3-ylmethyl)-5-oxo-N-pyridin-2-ylpyrrolidine-2-carboxamide (CID 91955710) is 1-(1H-indol-3-ylmethyl)-5-oxo-N-pyridin-2-ylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(1H-indol-3-ylmethyl)-5-oxo-N-pyridin-2-ylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-(1H-indol-3-ylmethyl)-5-oxo-N-pyridin-2-ylpyrrolidine-2-carboxamide is O=C(Nc1ccccn1)C1CCC(=O)N1Cc1c[nH]c2ccccc12.
What is the InChIKey of 1-(1H-indol-3-ylmethyl)-5-oxo-N-pyridin-2-ylpyrrolidine-2-carboxamide?
The InChIKey is PQVPQYGTKUAHJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c24-18-9-8-16(19(25)22-17-7-3-4-10-20-17)23(18)12-13-11-21-15-6-2-1-5-14(13)15/h1-7,10-11,16,21H,8-9,12H2,(H,20,22,25).
What are the key properties of 1-(1H-indol-3-ylmethyl)-5-oxo-N-pyridin-2-ylpyrrolidine-2-carboxamide?
1-(1H-indol-3-ylmethyl)-5-oxo-N-pyridin-2-ylpyrrolidine-2-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 2.69, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-indol-3-ylmethyl)-5-oxo-N-pyridin-2-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 91955710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).