2-[2-(2-chlorophenyl)-4-methyl-6,7-dihydro-3H-pyrazolo[4,3-c]pyridin-5-yl]-1-morpholin-4-ylethanone

C19H23ClN4O2 — CID 91390090

IUPAC2-[2-(2-chlorophenyl)-4-methyl-6,7-dihydro-3H-pyrazolo[4,3-c]pyridin-5-yl]-1-morpholin-4-ylethanone
SMILESCC1=C2CN(c3ccccc3Cl)N=C2CCN1CC(=O)N1CCOCC1
InChIInChI=1S/C19H23ClN4O2/c1-14-15-12-24(18-5-3-2-4-16(18)20)21-17(15)6-7-23(14)13-19(25)22-8-10-26-11-9-22/h2-5H,6-13H2,1H3
InChIKeyPVEYUDQVEHCRRD-UHFFFAOYSA-N
MW374.87 g/mol
LogP2.35
Rot. Bonds3

About 2-[2-(2-chlorophenyl)-4-methyl-6,7-dihydro-3H-pyrazolo[4,3-c]pyridin-5-yl]-1-morpholin-4-ylethanone

2-[2-(2-chlorophenyl)-4-methyl-6,7-dihydro-3H-pyrazolo[4,3-c]pyridin-5-yl]-1-morpholin-4-ylethanone (PubChem CID 91390090) has the molecular formula C19H23ClN4O2 and a molecular weight of 374.87 g/mol. Its IUPAC name is 2-[2-(2-chlorophenyl)-4-methyl-6,7-dihydro-3H-pyrazolo[4,3-c]pyridin-5-yl]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[2-(2-chlorophenyl)-4-methyl-6,7-dihydro-3H-pyrazolo[4,3-c]pyridin-5-yl]-1-morpholin-4-ylethanone
PubChem CID91390090
Molecular FormulaC19H23ClN4O2
Molecular Weight374.87 g/mol
Exact Mass374.15
IUPAC Name2-[2-(2-chlorophenyl)-4-methyl-6,7-dihydro-3H-pyrazolo[4,3-c]pyridin-5-yl]-1-morpholin-4-ylethanone
SMILESCC1=C2CN(c3ccccc3Cl)N=C2CCN1CC(=O)N1CCOCC1
InChIInChI=1S/C19H23ClN4O2/c1-14-15-12-24(18-5-3-2-4-16(18)20)21-17(15)6-7-23(14)13-19(25)22-8-10-26-11-9-22/h2-5H,6-13H2,1H3
InChIKeyPVEYUDQVEHCRRD-UHFFFAOYSA-N
XLogP2.35
TPSA48.38 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.87
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-chlorophenyl)-4-methyl-6,7-dihydro-3H-pyrazolo[4,3-c]pyridin-5-yl]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[2-(2-chlorophenyl)-4-methyl-6,7-dihydro-3H-pyrazolo[4,3-c]pyridin-5-yl]-1-morpholin-4-ylethanone (CID 91390090) is 2-[2-(2-chlorophenyl)-4-methyl-6,7-dihydro-3H-pyrazolo[4,3-c]pyridin-5-yl]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[2-(2-chlorophenyl)-4-methyl-6,7-dihydro-3H-pyrazolo[4,3-c]pyridin-5-yl]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[2-(2-chlorophenyl)-4-methyl-6,7-dihydro-3H-pyrazolo[4,3-c]pyridin-5-yl]-1-morpholin-4-ylethanone is CC1=C2CN(c3ccccc3Cl)N=C2CCN1CC(=O)N1CCOCC1.
What is the InChIKey of 2-[2-(2-chlorophenyl)-4-methyl-6,7-dihydro-3H-pyrazolo[4,3-c]pyridin-5-yl]-1-morpholin-4-ylethanone?
The InChIKey is PVEYUDQVEHCRRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN4O2/c1-14-15-12-24(18-5-3-2-4-16(18)20)21-17(15)6-7-23(14)13-19(25)22-8-10-26-11-9-22/h2-5H,6-13H2,1H3.
What are the key properties of 2-[2-(2-chlorophenyl)-4-methyl-6,7-dihydro-3H-pyrazolo[4,3-c]pyridin-5-yl]-1-morpholin-4-ylethanone?
2-[2-(2-chlorophenyl)-4-methyl-6,7-dihydro-3H-pyrazolo[4,3-c]pyridin-5-yl]-1-morpholin-4-ylethanone has a molecular weight of 374.87 g/mol, XLogP of 2.35, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-chlorophenyl)-4-methyl-6,7-dihydro-3H-pyrazolo[4,3-c]pyridin-5-yl]-1-morpholin-4-ylethanone is sourced from PubChem (CID 91390090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).