N-(1-benzylpiperidin-4-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide

C23H24N4O2 — CID 20954218

IUPACN-(1-benzylpiperidin-4-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide
SMILESO=C(NC1CCN(Cc2ccccc2)CC1)c1[nH]nc2c1COc1ccccc1-2
InChIInChI=1S/C23H24N4O2/c28-23(22-19-15-29-20-9-5-4-8-18(20)21(19)25-26-22)24-17-10-12-27(13-11-17)14-16-6-2-1-3-7-16/h1-9,17H,10-15H2,(H,24,28)(H,25,26)
InChIKeyJGWKFNQXNMUCJK-UHFFFAOYSA-N
MW388.47 g/mol
LogP3.36
Rot. Bonds4

About N-(1-benzylpiperidin-4-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide

N-(1-benzylpiperidin-4-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide (PubChem CID 20954218) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is N-(1-benzylpiperidin-4-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-4-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide
PubChem CID20954218
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC NameN-(1-benzylpiperidin-4-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide
SMILESO=C(NC1CCN(Cc2ccccc2)CC1)c1[nH]nc2c1COc1ccccc1-2
InChIInChI=1S/C23H24N4O2/c28-23(22-19-15-29-20-9-5-4-8-18(20)21(19)25-26-22)24-17-10-12-27(13-11-17)14-16-6-2-1-3-7-16/h1-9,17H,10-15H2,(H,24,28)(H,25,26)
InChIKeyJGWKFNQXNMUCJK-UHFFFAOYSA-N
XLogP3.36
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-4-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide?
The IUPAC name of N-(1-benzylpiperidin-4-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide (CID 20954218) is N-(1-benzylpiperidin-4-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide.
What is the SMILES notation for N-(1-benzylpiperidin-4-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide?
The canonical SMILES for N-(1-benzylpiperidin-4-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide is O=C(NC1CCN(Cc2ccccc2)CC1)c1[nH]nc2c1COc1ccccc1-2.
What is the InChIKey of N-(1-benzylpiperidin-4-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide?
The InChIKey is JGWKFNQXNMUCJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c28-23(22-19-15-29-20-9-5-4-8-18(20)21(19)25-26-22)24-17-10-12-27(13-11-17)14-16-6-2-1-3-7-16/h1-9,17H,10-15H2,(H,24,28)(H,25,26).
What are the key properties of N-(1-benzylpiperidin-4-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide?
N-(1-benzylpiperidin-4-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide has a molecular weight of 388.47 g/mol, XLogP of 3.36, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-4-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide is sourced from PubChem (CID 20954218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).