1-(2-methoxyethyl)-4-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-ylmethyl)pyrrolidin-2-one

C14H22N4O2 — CID 118762548

IUPAC1-(2-methoxyethyl)-4-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-ylmethyl)pyrrolidin-2-one
SMILESCOCCN1CC(CN2CCc3[nH]ncc3C2)CC1=O
InChIInChI=1S/C14H22N4O2/c1-20-5-4-18-9-11(6-14(18)19)8-17-3-2-13-12(10-17)7-15-16-13/h7,11H,2-6,8-10H2,1H3,(H,15,16)
InChIKeyQGYMFJCPFFDSEZ-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.26
Rot. Bonds5

About 1-(2-methoxyethyl)-4-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-ylmethyl)pyrrolidin-2-one

1-(2-methoxyethyl)-4-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-ylmethyl)pyrrolidin-2-one (PubChem CID 118762548) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-4-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-ylmethyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(2-methoxyethyl)-4-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-ylmethyl)pyrrolidin-2-one
PubChem CID118762548
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name1-(2-methoxyethyl)-4-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-ylmethyl)pyrrolidin-2-one
SMILESCOCCN1CC(CN2CCc3[nH]ncc3C2)CC1=O
InChIInChI=1S/C14H22N4O2/c1-20-5-4-18-9-11(6-14(18)19)8-17-3-2-13-12(10-17)7-15-16-13/h7,11H,2-6,8-10H2,1H3,(H,15,16)
InChIKeyQGYMFJCPFFDSEZ-UHFFFAOYSA-N
XLogP0.26
TPSA61.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2-methoxyethyl)-4-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-ylmethyl)pyrrolidin-2-one with MolForge

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Related Compounds

5-Boc-1,4,6,7-tetrahydropyrazolo[4,3-C]pyridine
CID 10398680
(2R)-3,3,3-trifluoro-2-hydroxy-2-methyl-1-[(7R)-7-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]propan-1-one
CID 126527256
(2R)-3,3,3-trifluoro-2-hydroxy-2-methyl-1-[(7S)-7-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]propan-1-one
CID 126527165
3-methoxy-1-[3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]propan-1-one
CID 110256062
[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]-(oxan-4-yl)methanone
CID 110271074
methyl N-[(2S)-1-oxo-1-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-yl)propan-2-yl]carbamate
CID 100066220
2-tert-butyl-5-[[(7S)-7-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-yl]methyl]-1,3,4-oxadiazole
CID 164635463
(4S)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-4-morpholin-4-ylpentanamide
CID 164636064
(2S)-2-cyclopropyl-1-(7,7-dimethyl-4,6-dihydro-1H-pyrazolo[4,5-c]pyridin-5-yl)propan-1-one
CID 164643197
3,3,3-Trifluoro-2-hydroxy-2-methyl-1-(7-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-yl)propan-1-one
CID 126527166
3,3,3-Trifluoro-2-hydroxy-1-(7-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-yl)propan-1-one
CID 126571037
3,3,3-trifluoro-2-hydroxy-2-methyl-1-[(7S)-7-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-yl]propan-1-one
CID 137378997

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-4-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-ylmethyl)pyrrolidin-2-one?
The IUPAC name of 1-(2-methoxyethyl)-4-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-ylmethyl)pyrrolidin-2-one (CID 118762548) is 1-(2-methoxyethyl)-4-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-ylmethyl)pyrrolidin-2-one.
What is the SMILES notation for 1-(2-methoxyethyl)-4-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-ylmethyl)pyrrolidin-2-one?
The canonical SMILES for 1-(2-methoxyethyl)-4-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-ylmethyl)pyrrolidin-2-one is COCCN1CC(CN2CCc3[nH]ncc3C2)CC1=O.
What is the InChIKey of 1-(2-methoxyethyl)-4-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-ylmethyl)pyrrolidin-2-one?
The InChIKey is QGYMFJCPFFDSEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-20-5-4-18-9-11(6-14(18)19)8-17-3-2-13-12(10-17)7-15-16-13/h7,11H,2-6,8-10H2,1H3,(H,15,16).
What are the key properties of 1-(2-methoxyethyl)-4-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-ylmethyl)pyrrolidin-2-one?
1-(2-methoxyethyl)-4-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-ylmethyl)pyrrolidin-2-one has a molecular weight of 278.36 g/mol, XLogP of 0.26, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-4-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-ylmethyl)pyrrolidin-2-one is sourced from PubChem (CID 118762548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).