N-cyclopropyl-1-[(4-phenylpyrazol-1-yl)methyl]piperidine-4-carboxamide

C19H24N4O — CID 51097163

IUPACN-cyclopropyl-1-[(4-phenylpyrazol-1-yl)methyl]piperidine-4-carboxamide
SMILESO=C(NC1CC1)C1CCN(Cn2cc(-c3ccccc3)cn2)CC1
InChIInChI=1S/C19H24N4O/c24-19(21-18-6-7-18)16-8-10-22(11-9-16)14-23-13-17(12-20-23)15-4-2-1-3-5-15/h1-5,12-13,16,18H,6-11,14H2,(H,21,24)
InChIKeyOAHVXTBSEMADKS-UHFFFAOYSA-N
MW324.43 g/mol
LogP2.50
Rot. Bonds5

About N-cyclopropyl-1-[(4-phenylpyrazol-1-yl)methyl]piperidine-4-carboxamide

N-cyclopropyl-1-[(4-phenylpyrazol-1-yl)methyl]piperidine-4-carboxamide (PubChem CID 51097163) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is N-cyclopropyl-1-[(4-phenylpyrazol-1-yl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-[(4-phenylpyrazol-1-yl)methyl]piperidine-4-carboxamide
PubChem CID51097163
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC NameN-cyclopropyl-1-[(4-phenylpyrazol-1-yl)methyl]piperidine-4-carboxamide
SMILESO=C(NC1CC1)C1CCN(Cn2cc(-c3ccccc3)cn2)CC1
InChIInChI=1S/C19H24N4O/c24-19(21-18-6-7-18)16-8-10-22(11-9-16)14-23-13-17(12-20-23)15-4-2-1-3-5-15/h1-5,12-13,16,18H,6-11,14H2,(H,21,24)
InChIKeyOAHVXTBSEMADKS-UHFFFAOYSA-N
XLogP2.50
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-[(4-phenylpyrazol-1-yl)methyl]piperidine-4-carboxamide?
The IUPAC name of N-cyclopropyl-1-[(4-phenylpyrazol-1-yl)methyl]piperidine-4-carboxamide (CID 51097163) is N-cyclopropyl-1-[(4-phenylpyrazol-1-yl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-[(4-phenylpyrazol-1-yl)methyl]piperidine-4-carboxamide?
The canonical SMILES for N-cyclopropyl-1-[(4-phenylpyrazol-1-yl)methyl]piperidine-4-carboxamide is O=C(NC1CC1)C1CCN(Cn2cc(-c3ccccc3)cn2)CC1.
What is the InChIKey of N-cyclopropyl-1-[(4-phenylpyrazol-1-yl)methyl]piperidine-4-carboxamide?
The InChIKey is OAHVXTBSEMADKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c24-19(21-18-6-7-18)16-8-10-22(11-9-16)14-23-13-17(12-20-23)15-4-2-1-3-5-15/h1-5,12-13,16,18H,6-11,14H2,(H,21,24).
What are the key properties of N-cyclopropyl-1-[(4-phenylpyrazol-1-yl)methyl]piperidine-4-carboxamide?
N-cyclopropyl-1-[(4-phenylpyrazol-1-yl)methyl]piperidine-4-carboxamide has a molecular weight of 324.43 g/mol, XLogP of 2.50, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-[(4-phenylpyrazol-1-yl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 51097163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).