3-hydroxy-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]piperidine-1-carboxamide

C19H24N4O2 — CID 71938734

IUPAC3-hydroxy-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]piperidine-1-carboxamide
SMILESO=C(NCc1nn(-c2ccccc2)c2c1CCC2)N1CCCC(O)C1
InChIInChI=1S/C19H24N4O2/c24-15-8-5-11-22(13-15)19(25)20-12-17-16-9-4-10-18(16)23(21-17)14-6-2-1-3-7-14/h1-3,6-7,15,24H,4-5,8-13H2,(H,20,25)
InChIKeyVVEJVLPLZHCRGA-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.03
Rot. Bonds3

About 3-hydroxy-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]piperidine-1-carboxamide

3-hydroxy-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]piperidine-1-carboxamide (PubChem CID 71938734) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 3-hydroxy-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]piperidine-1-carboxamide
PubChem CID71938734
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name3-hydroxy-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]piperidine-1-carboxamide
SMILESO=C(NCc1nn(-c2ccccc2)c2c1CCC2)N1CCCC(O)C1
InChIInChI=1S/C19H24N4O2/c24-15-8-5-11-22(13-15)19(25)20-12-17-16-9-4-10-18(16)23(21-17)14-6-2-1-3-7-14/h1-3,6-7,15,24H,4-5,8-13H2,(H,20,25)
InChIKeyVVEJVLPLZHCRGA-UHFFFAOYSA-N
XLogP2.03
TPSA70.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]piperidine-1-carboxamide?
The IUPAC name of 3-hydroxy-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]piperidine-1-carboxamide (CID 71938734) is 3-hydroxy-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]piperidine-1-carboxamide.
What is the SMILES notation for 3-hydroxy-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]piperidine-1-carboxamide?
The canonical SMILES for 3-hydroxy-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]piperidine-1-carboxamide is O=C(NCc1nn(-c2ccccc2)c2c1CCC2)N1CCCC(O)C1.
What is the InChIKey of 3-hydroxy-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]piperidine-1-carboxamide?
The InChIKey is VVEJVLPLZHCRGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c24-15-8-5-11-22(13-15)19(25)20-12-17-16-9-4-10-18(16)23(21-17)14-6-2-1-3-7-14/h1-3,6-7,15,24H,4-5,8-13H2,(H,20,25).
What are the key properties of 3-hydroxy-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]piperidine-1-carboxamide?
3-hydroxy-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]piperidine-1-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.03, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-[(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]piperidine-1-carboxamide is sourced from PubChem (CID 71938734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).