N-[2-(6-chloropyrazolo[1,5-a]pyridine-2-carbonyl)-1-methyl-3,4-dihydrocinnolin-8-yl]acetamide

C19H18ClN5O2 — CID 68801997

IUPACN-[2-(6-chloropyrazolo[1,5-a]pyridine-2-carbonyl)-1-methyl-3,4-dihydrocinnolin-8-yl]acetamide
SMILESCC(=O)Nc1cccc2c1N(C)N(C(=O)c1cc3ccc(Cl)cn3n1)CC2
InChIInChI=1S/C19H18ClN5O2/c1-12(26)21-16-5-3-4-13-8-9-25(23(2)18(13)16)19(27)17-10-15-7-6-14(20)11-24(15)22-17/h3-7,10-11H,8-9H2,1-2H3,(H,21,26)
InChIKeyFYIQYCCZSQAPEX-UHFFFAOYSA-N
MW383.84 g/mol
LogP3.00
Rot. Bonds2

About N-[2-(6-chloropyrazolo[1,5-a]pyridine-2-carbonyl)-1-methyl-3,4-dihydrocinnolin-8-yl]acetamide

N-[2-(6-chloropyrazolo[1,5-a]pyridine-2-carbonyl)-1-methyl-3,4-dihydrocinnolin-8-yl]acetamide (PubChem CID 68801997) has the molecular formula C19H18ClN5O2 and a molecular weight of 383.84 g/mol. Its IUPAC name is N-[2-(6-chloropyrazolo[1,5-a]pyridine-2-carbonyl)-1-methyl-3,4-dihydrocinnolin-8-yl]acetamide.

Molecular Properties

Compound NameN-[2-(6-chloropyrazolo[1,5-a]pyridine-2-carbonyl)-1-methyl-3,4-dihydrocinnolin-8-yl]acetamide
PubChem CID68801997
Molecular FormulaC19H18ClN5O2
Molecular Weight383.84 g/mol
Exact Mass383.11
IUPAC NameN-[2-(6-chloropyrazolo[1,5-a]pyridine-2-carbonyl)-1-methyl-3,4-dihydrocinnolin-8-yl]acetamide
SMILESCC(=O)Nc1cccc2c1N(C)N(C(=O)c1cc3ccc(Cl)cn3n1)CC2
InChIInChI=1S/C19H18ClN5O2/c1-12(26)21-16-5-3-4-13-8-9-25(23(2)18(13)16)19(27)17-10-15-7-6-14(20)11-24(15)22-17/h3-7,10-11H,8-9H2,1-2H3,(H,21,26)
InChIKeyFYIQYCCZSQAPEX-UHFFFAOYSA-N
XLogP3.00
TPSA69.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.84
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(6-chloropyrazolo[1,5-a]pyridine-2-carbonyl)-1-methyl-3,4-dihydrocinnolin-8-yl]acetamide?
The IUPAC name of N-[2-(6-chloropyrazolo[1,5-a]pyridine-2-carbonyl)-1-methyl-3,4-dihydrocinnolin-8-yl]acetamide (CID 68801997) is N-[2-(6-chloropyrazolo[1,5-a]pyridine-2-carbonyl)-1-methyl-3,4-dihydrocinnolin-8-yl]acetamide.
What is the SMILES notation for N-[2-(6-chloropyrazolo[1,5-a]pyridine-2-carbonyl)-1-methyl-3,4-dihydrocinnolin-8-yl]acetamide?
The canonical SMILES for N-[2-(6-chloropyrazolo[1,5-a]pyridine-2-carbonyl)-1-methyl-3,4-dihydrocinnolin-8-yl]acetamide is CC(=O)Nc1cccc2c1N(C)N(C(=O)c1cc3ccc(Cl)cn3n1)CC2.
What is the InChIKey of N-[2-(6-chloropyrazolo[1,5-a]pyridine-2-carbonyl)-1-methyl-3,4-dihydrocinnolin-8-yl]acetamide?
The InChIKey is FYIQYCCZSQAPEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN5O2/c1-12(26)21-16-5-3-4-13-8-9-25(23(2)18(13)16)19(27)17-10-15-7-6-14(20)11-24(15)22-17/h3-7,10-11H,8-9H2,1-2H3,(H,21,26).
What are the key properties of N-[2-(6-chloropyrazolo[1,5-a]pyridine-2-carbonyl)-1-methyl-3,4-dihydrocinnolin-8-yl]acetamide?
N-[2-(6-chloropyrazolo[1,5-a]pyridine-2-carbonyl)-1-methyl-3,4-dihydrocinnolin-8-yl]acetamide has a molecular weight of 383.84 g/mol, XLogP of 3.00, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-chloropyrazolo[1,5-a]pyridine-2-carbonyl)-1-methyl-3,4-dihydrocinnolin-8-yl]acetamide is sourced from PubChem (CID 68801997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).