(6-chloropyrazolo[1,5-a]pyridin-2-yl)-(1,6-dimethyl-3,4-dihydrocinnolin-2-yl)methanone

C18H17ClN4O — CID 68798683

IUPAC(6-chloropyrazolo[1,5-a]pyridin-2-yl)-(1,6-dimethyl-3,4-dihydrocinnolin-2-yl)methanone
SMILESCc1ccc2c(c1)CCN(C(=O)c1cc3ccc(Cl)cn3n1)N2C
InChIInChI=1S/C18H17ClN4O/c1-12-3-6-17-13(9-12)7-8-23(21(17)2)18(24)16-10-15-5-4-14(19)11-22(15)20-16/h3-6,9-11H,7-8H2,1-2H3
InChIKeyGAGHLDNXNJQVLB-UHFFFAOYSA-N
MW340.81 g/mol
LogP3.35
Rot. Bonds1

About (6-chloropyrazolo[1,5-a]pyridin-2-yl)-(1,6-dimethyl-3,4-dihydrocinnolin-2-yl)methanone

(6-chloropyrazolo[1,5-a]pyridin-2-yl)-(1,6-dimethyl-3,4-dihydrocinnolin-2-yl)methanone (PubChem CID 68798683) has the molecular formula C18H17ClN4O and a molecular weight of 340.81 g/mol. Its IUPAC name is (6-chloropyrazolo[1,5-a]pyridin-2-yl)-(1,6-dimethyl-3,4-dihydrocinnolin-2-yl)methanone.

Molecular Properties

Compound Name(6-chloropyrazolo[1,5-a]pyridin-2-yl)-(1,6-dimethyl-3,4-dihydrocinnolin-2-yl)methanone
PubChem CID68798683
Molecular FormulaC18H17ClN4O
Molecular Weight340.81 g/mol
Exact Mass340.11
IUPAC Name(6-chloropyrazolo[1,5-a]pyridin-2-yl)-(1,6-dimethyl-3,4-dihydrocinnolin-2-yl)methanone
SMILESCc1ccc2c(c1)CCN(C(=O)c1cc3ccc(Cl)cn3n1)N2C
InChIInChI=1S/C18H17ClN4O/c1-12-3-6-17-13(9-12)7-8-23(21(17)2)18(24)16-10-15-5-4-14(19)11-22(15)20-16/h3-6,9-11H,7-8H2,1-2H3
InChIKeyGAGHLDNXNJQVLB-UHFFFAOYSA-N
XLogP3.35
TPSA40.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.81
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (6-chloropyrazolo[1,5-a]pyridin-2-yl)-(1,6-dimethyl-3,4-dihydrocinnolin-2-yl)methanone?
The IUPAC name of (6-chloropyrazolo[1,5-a]pyridin-2-yl)-(1,6-dimethyl-3,4-dihydrocinnolin-2-yl)methanone (CID 68798683) is (6-chloropyrazolo[1,5-a]pyridin-2-yl)-(1,6-dimethyl-3,4-dihydrocinnolin-2-yl)methanone.
What is the SMILES notation for (6-chloropyrazolo[1,5-a]pyridin-2-yl)-(1,6-dimethyl-3,4-dihydrocinnolin-2-yl)methanone?
The canonical SMILES for (6-chloropyrazolo[1,5-a]pyridin-2-yl)-(1,6-dimethyl-3,4-dihydrocinnolin-2-yl)methanone is Cc1ccc2c(c1)CCN(C(=O)c1cc3ccc(Cl)cn3n1)N2C.
What is the InChIKey of (6-chloropyrazolo[1,5-a]pyridin-2-yl)-(1,6-dimethyl-3,4-dihydrocinnolin-2-yl)methanone?
The InChIKey is GAGHLDNXNJQVLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN4O/c1-12-3-6-17-13(9-12)7-8-23(21(17)2)18(24)16-10-15-5-4-14(19)11-22(15)20-16/h3-6,9-11H,7-8H2,1-2H3.
What are the key properties of (6-chloropyrazolo[1,5-a]pyridin-2-yl)-(1,6-dimethyl-3,4-dihydrocinnolin-2-yl)methanone?
(6-chloropyrazolo[1,5-a]pyridin-2-yl)-(1,6-dimethyl-3,4-dihydrocinnolin-2-yl)methanone has a molecular weight of 340.81 g/mol, XLogP of 3.35, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloropyrazolo[1,5-a]pyridin-2-yl)-(1,6-dimethyl-3,4-dihydrocinnolin-2-yl)methanone is sourced from PubChem (CID 68798683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).