1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(1-propan-2-ylpiperidin-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide

C25H37N5O2 — CID 45162767

IUPAC1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(1-propan-2-ylpiperidin-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
SMILESCC(NC(=O)c1nn(CCO)c2c1CN(C1CCN(C(C)C)CC1)CC2)c1ccccc1
InChIInChI=1S/C25H37N5O2/c1-18(2)28-12-9-21(10-13-28)29-14-11-23-22(17-29)24(27-30(23)15-16-31)25(32)26-19(3)20-7-5-4-6-8-20/h4-8,18-19,21,31H,9-17H2,1-3H3,(H,26,32)
InChIKeyXDBRCWYNSCWTKF-UHFFFAOYSA-N
MW439.60 g/mol
LogP2.60
Rot. Bonds7

About 1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(1-propan-2-ylpiperidin-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide

1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(1-propan-2-ylpiperidin-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide (PubChem CID 45162767) has the molecular formula C25H37N5O2 and a molecular weight of 439.60 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(1-propan-2-ylpiperidin-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide.

Molecular Properties

Compound Name1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(1-propan-2-ylpiperidin-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
PubChem CID45162767
Molecular FormulaC25H37N5O2
Molecular Weight439.60 g/mol
Exact Mass439.29
IUPAC Name1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(1-propan-2-ylpiperidin-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
SMILESCC(NC(=O)c1nn(CCO)c2c1CN(C1CCN(C(C)C)CC1)CC2)c1ccccc1
InChIInChI=1S/C25H37N5O2/c1-18(2)28-12-9-21(10-13-28)29-14-11-23-22(17-29)24(27-30(23)15-16-31)25(32)26-19(3)20-7-5-4-6-8-20/h4-8,18-19,21,31H,9-17H2,1-3H3,(H,26,32)
InChIKeyXDBRCWYNSCWTKF-UHFFFAOYSA-N
XLogP2.60
TPSA73.63 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.60
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 45163222
1-(2-hydroxyethyl)-5-[(5-methylfuran-2-yl)methyl]-N-(1-phenylethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 45164988
N-benzyl-5-cyclopentyl-1-(2-hydroxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 26229751
1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(7H-pyrrolo[1,2-c]imidazol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 130375370
ethyl 4-[3-(benzylcarbamoyl)-1-(2-hydroxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]piperidine-1-carboxylate
CID 26232987
5-(1-benzofuran-6-ylmethyl)-1-(2-hydroxyethyl)-N-(1-phenylethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 118933243
1-benzyl-N-[(1R)-1-phenylethyl]-4,5,6,7-tetrahydroindazole-3-carboxamide
CID 143116638
N-benzyl-1-(2-hydroxyethyl)-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 26225988
4-[4-(2-hydroxyethyl)piperazin-1-yl]-N-[(1S)-1-phenylethyl]piperidine-1-carboxamide
CID 122570435
1-methyl-3-N,4-N-bis[(1R)-1-phenylethyl]pyrazole-3,4-dicarboxamide
CID 29097432
N-benzyl-1-(2-hydroxyethyl)-5-(3-methylbut-2-enyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 26140157
N-benzyl-5-[(3,5-dimethylphenyl)methyl]-1-(2-hydroxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 26143204

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(1-propan-2-ylpiperidin-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?
The IUPAC name of 1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(1-propan-2-ylpiperidin-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide (CID 45162767) is 1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(1-propan-2-ylpiperidin-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide.
What is the SMILES notation for 1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(1-propan-2-ylpiperidin-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?
The canonical SMILES for 1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(1-propan-2-ylpiperidin-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide is CC(NC(=O)c1nn(CCO)c2c1CN(C1CCN(C(C)C)CC1)CC2)c1ccccc1.
What is the InChIKey of 1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(1-propan-2-ylpiperidin-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?
The InChIKey is XDBRCWYNSCWTKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H37N5O2/c1-18(2)28-12-9-21(10-13-28)29-14-11-23-22(17-29)24(27-30(23)15-16-31)25(32)26-19(3)20-7-5-4-6-8-20/h4-8,18-19,21,31H,9-17H2,1-3H3,(H,26,32).
What are the key properties of 1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(1-propan-2-ylpiperidin-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?
1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(1-propan-2-ylpiperidin-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide has a molecular weight of 439.60 g/mol, XLogP of 2.60, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)-N-(1-phenylethyl)-5-(1-propan-2-ylpiperidin-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide is sourced from PubChem (CID 45162767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).