2,4-dihydrochromeno[4,3-c]pyrazol-3-yl(piperidin-1-yl)methanone

C16H17N3O2 — CID 166302472

IUPAC2,4-dihydrochromeno[4,3-c]pyrazol-3-yl(piperidin-1-yl)methanone
SMILESO=C(c1[nH]nc2c1COc1ccccc1-2)N1CCCCC1
InChIInChI=1S/C16H17N3O2/c20-16(19-8-4-1-5-9-19)15-12-10-21-13-7-3-2-6-11(13)14(12)17-18-15/h2-3,6-7H,1,4-5,8-10H2,(H,17,18)
InChIKeyCZDIGQWCDIPFFK-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.60
Rot. Bonds1

About 2,4-dihydrochromeno[4,3-c]pyrazol-3-yl(piperidin-1-yl)methanone

2,4-dihydrochromeno[4,3-c]pyrazol-3-yl(piperidin-1-yl)methanone (PubChem CID 166302472) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 2,4-dihydrochromeno[4,3-c]pyrazol-3-yl(piperidin-1-yl)methanone.

Molecular Properties

Compound Name2,4-dihydrochromeno[4,3-c]pyrazol-3-yl(piperidin-1-yl)methanone
PubChem CID166302472
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name2,4-dihydrochromeno[4,3-c]pyrazol-3-yl(piperidin-1-yl)methanone
SMILESO=C(c1[nH]nc2c1COc1ccccc1-2)N1CCCCC1
InChIInChI=1S/C16H17N3O2/c20-16(19-8-4-1-5-9-19)15-12-10-21-13-7-3-2-6-11(13)14(12)17-18-15/h2-3,6-7H,1,4-5,8-10H2,(H,17,18)
InChIKeyCZDIGQWCDIPFFK-UHFFFAOYSA-N
XLogP2.60
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-piperidin-1-ylpropyl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide
CID 20954247
N-[[(1S,9aS)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl]-N-methyl-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide
CID 126418654
N-(1-hydroxypropan-2-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide
CID 91821763
N-(2-carbamoylphenyl)-N-methyl-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide
CID 67305110
N-(2-hydroxy-1-phenylethyl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide
CID 91820892
N-(4-chlorophenyl)-N-methyl-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide
CID 67304559
N-[3-(2-oxopyrrolidin-1-yl)propyl]-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide
CID 20954207
N-(thiophen-2-ylmethyl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide
CID 71802842
N-(1-benzylpiperidin-4-yl)-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide
CID 20954218
1-(4,5-dihydro-2H-benzo[g]indazole-3-carbonyl)-4-piperidin-1-ylpiperidine-4-carboxamide
CID 20953917
2,4-dihydrothiochromeno[4,3-c]pyrazol-3-yl(morpholin-4-yl)methanone
CID 123401361
N-[2-(cyclohexen-1-yl)ethyl]-2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxamide
CID 20954225

Frequently Asked Questions

What is the IUPAC name of 2,4-dihydrochromeno[4,3-c]pyrazol-3-yl(piperidin-1-yl)methanone?
The IUPAC name of 2,4-dihydrochromeno[4,3-c]pyrazol-3-yl(piperidin-1-yl)methanone (CID 166302472) is 2,4-dihydrochromeno[4,3-c]pyrazol-3-yl(piperidin-1-yl)methanone.
What is the SMILES notation for 2,4-dihydrochromeno[4,3-c]pyrazol-3-yl(piperidin-1-yl)methanone?
The canonical SMILES for 2,4-dihydrochromeno[4,3-c]pyrazol-3-yl(piperidin-1-yl)methanone is O=C(c1[nH]nc2c1COc1ccccc1-2)N1CCCCC1.
What is the InChIKey of 2,4-dihydrochromeno[4,3-c]pyrazol-3-yl(piperidin-1-yl)methanone?
The InChIKey is CZDIGQWCDIPFFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c20-16(19-8-4-1-5-9-19)15-12-10-21-13-7-3-2-6-11(13)14(12)17-18-15/h2-3,6-7H,1,4-5,8-10H2,(H,17,18).
What are the key properties of 2,4-dihydrochromeno[4,3-c]pyrazol-3-yl(piperidin-1-yl)methanone?
2,4-dihydrochromeno[4,3-c]pyrazol-3-yl(piperidin-1-yl)methanone has a molecular weight of 283.33 g/mol, XLogP of 2.60, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dihydrochromeno[4,3-c]pyrazol-3-yl(piperidin-1-yl)methanone is sourced from PubChem (CID 166302472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).