N-[(5-oxo-4H-pyrazolo[1,5-a]quinazolin-3-yl)methyl]-3-piperidin-1-ylpropanamide

C19H23N5O2 — CID 135939638

IUPACN-[(5-oxo-4H-pyrazolo[1,5-a]quinazolin-3-yl)methyl]-3-piperidin-1-ylpropanamide
SMILESO=C(CCN1CCCCC1)NCc1cnn2c1[nH]c(=O)c1ccccc12
InChIInChI=1S/C19H23N5O2/c25-17(8-11-23-9-4-1-5-10-23)20-12-14-13-21-24-16-7-3-2-6-15(16)19(26)22-18(14)24/h2-3,6-7,13H,1,4-5,8-12H2,(H,20,25)(H,22,26)
InChIKeyYKCOKRPQQACTAF-UHFFFAOYSA-N
MW353.43 g/mol
LogP1.67
Rot. Bonds5

About N-[(5-oxo-4H-pyrazolo[1,5-a]quinazolin-3-yl)methyl]-3-piperidin-1-ylpropanamide

N-[(5-oxo-4H-pyrazolo[1,5-a]quinazolin-3-yl)methyl]-3-piperidin-1-ylpropanamide (PubChem CID 135939638) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is N-[(5-oxo-4H-pyrazolo[1,5-a]quinazolin-3-yl)methyl]-3-piperidin-1-ylpropanamide.

Molecular Properties

Compound NameN-[(5-oxo-4H-pyrazolo[1,5-a]quinazolin-3-yl)methyl]-3-piperidin-1-ylpropanamide
PubChem CID135939638
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC NameN-[(5-oxo-4H-pyrazolo[1,5-a]quinazolin-3-yl)methyl]-3-piperidin-1-ylpropanamide
SMILESO=C(CCN1CCCCC1)NCc1cnn2c1[nH]c(=O)c1ccccc12
InChIInChI=1S/C19H23N5O2/c25-17(8-11-23-9-4-1-5-10-23)20-12-14-13-21-24-16-7-3-2-6-15(16)19(26)22-18(14)24/h2-3,6-7,13H,1,4-5,8-12H2,(H,20,25)(H,22,26)
InChIKeyYKCOKRPQQACTAF-UHFFFAOYSA-N
XLogP1.67
TPSA82.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(5-oxo-4H-pyrazolo[1,5-a]quinazolin-3-yl)methyl]-3-piperidin-1-ylpropanamide?
The IUPAC name of N-[(5-oxo-4H-pyrazolo[1,5-a]quinazolin-3-yl)methyl]-3-piperidin-1-ylpropanamide (CID 135939638) is N-[(5-oxo-4H-pyrazolo[1,5-a]quinazolin-3-yl)methyl]-3-piperidin-1-ylpropanamide.
What is the SMILES notation for N-[(5-oxo-4H-pyrazolo[1,5-a]quinazolin-3-yl)methyl]-3-piperidin-1-ylpropanamide?
The canonical SMILES for N-[(5-oxo-4H-pyrazolo[1,5-a]quinazolin-3-yl)methyl]-3-piperidin-1-ylpropanamide is O=C(CCN1CCCCC1)NCc1cnn2c1[nH]c(=O)c1ccccc12.
What is the InChIKey of N-[(5-oxo-4H-pyrazolo[1,5-a]quinazolin-3-yl)methyl]-3-piperidin-1-ylpropanamide?
The InChIKey is YKCOKRPQQACTAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O2/c25-17(8-11-23-9-4-1-5-10-23)20-12-14-13-21-24-16-7-3-2-6-15(16)19(26)22-18(14)24/h2-3,6-7,13H,1,4-5,8-12H2,(H,20,25)(H,22,26).
What are the key properties of N-[(5-oxo-4H-pyrazolo[1,5-a]quinazolin-3-yl)methyl]-3-piperidin-1-ylpropanamide?
N-[(5-oxo-4H-pyrazolo[1,5-a]quinazolin-3-yl)methyl]-3-piperidin-1-ylpropanamide has a molecular weight of 353.43 g/mol, XLogP of 1.67, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-oxo-4H-pyrazolo[1,5-a]quinazolin-3-yl)methyl]-3-piperidin-1-ylpropanamide is sourced from PubChem (CID 135939638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).