1-cyclopentyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide

C18H22N6O2 — CID 131937197

IUPAC1-cyclopentyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide
SMILESCc1nnnn1-c1cccc(NC(=O)C2CC(=O)N(C3CCCC3)C2)c1
InChIInChI=1S/C18H22N6O2/c1-12-20-21-22-24(12)16-8-4-5-14(10-16)19-18(26)13-9-17(25)23(11-13)15-6-2-3-7-15/h4-5,8,10,13,15H,2-3,6-7,9,11H2,1H3,(H,19,26)
InChIKeyMREKUYIIBGFBPA-UHFFFAOYSA-N
MW354.41 g/mol
LogP1.70
Rot. Bonds4

About 1-cyclopentyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide

1-cyclopentyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide (PubChem CID 131937197) has the molecular formula C18H22N6O2 and a molecular weight of 354.41 g/mol. Its IUPAC name is 1-cyclopentyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-cyclopentyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide
PubChem CID131937197
Molecular FormulaC18H22N6O2
Molecular Weight354.41 g/mol
Exact Mass354.18
IUPAC Name1-cyclopentyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide
SMILESCc1nnnn1-c1cccc(NC(=O)C2CC(=O)N(C3CCCC3)C2)c1
InChIInChI=1S/C18H22N6O2/c1-12-20-21-22-24(12)16-8-4-5-14(10-16)19-18(26)13-9-17(25)23(11-13)15-6-2-3-7-15/h4-5,8,10,13,15H,2-3,6-7,9,11H2,1H3,(H,19,26)
InChIKeyMREKUYIIBGFBPA-UHFFFAOYSA-N
XLogP1.70
TPSA93.01 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-cyclopentyl-N-[3-(cyclopropanecarbonylamino)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 46568551
4-[[3-(5-methyltetrazol-1-yl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 120672862
(3S)-1-cyclopentyl-N-(3-fluorophenyl)-5-oxopyrrolidine-3-carboxamide
CID 9364552
N-[3-(5-methyltetrazol-1-yl)phenyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119733107
(3S)-N-(3-bromophenyl)-1-cyclohexyl-5-oxopyrrolidine-3-carboxamide
CID 1116191
N-(3-bromo-4-methylphenyl)-1-cyclopentyl-5-oxopyrrolidine-3-carboxamide
CID 113182274
(3S)-1-cyclohexyl-5-oxo-N-phenylpyrrolidine-3-carboxamide
CID 2266114
1-[2-(3,4-dimethoxyphenyl)ethyl]-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 55676971
(3R)-1-cyclopentyl-N-[3-[[(2S)-2-methoxypropanoyl]amino]phenyl]-5-oxopyrrolidine-3-carboxamide
CID 95089235
(3R)-N-(3-acetylphenyl)-1-cyclopropyl-5-oxopyrrolidine-3-carboxamide
CID 39954335
N-(3-cyclopentyloxyphenyl)-1-cyclopropyl-5-oxopyrrolidine-3-carboxamide
CID 42949314
1-cycloheptyl-5-oxo-N-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide
CID 113185547

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-cyclopentyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide (CID 131937197) is 1-cyclopentyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-cyclopentyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-cyclopentyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide is Cc1nnnn1-c1cccc(NC(=O)C2CC(=O)N(C3CCCC3)C2)c1.
What is the InChIKey of 1-cyclopentyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide?
The InChIKey is MREKUYIIBGFBPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N6O2/c1-12-20-21-22-24(12)16-8-4-5-14(10-16)19-18(26)13-9-17(25)23(11-13)15-6-2-3-7-15/h4-5,8,10,13,15H,2-3,6-7,9,11H2,1H3,(H,19,26).
What are the key properties of 1-cyclopentyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide?
1-cyclopentyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide has a molecular weight of 354.41 g/mol, XLogP of 1.70, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 131937197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).