6-chloro-N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-2-ylmethoxy)quinazolin-4-amine

C18H16ClN5O — CID 165415105

IUPAC6-chloro-N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-2-ylmethoxy)quinazolin-4-amine
SMILESCN(C)c1nc(OCc2cc3ccccn3n2)nc2ccc(Cl)cc12
InChIInChI=1S/C18H16ClN5O/c1-23(2)17-15-9-12(19)6-7-16(15)20-18(21-17)25-11-13-10-14-5-3-4-8-24(14)22-13/h3-10H,11H2,1-2H3
InChIKeyRBQXSZWTRKCCEI-UHFFFAOYSA-N
MW353.81 g/mol
LogP3.58
Rot. Bonds4

About 6-chloro-N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-2-ylmethoxy)quinazolin-4-amine

6-chloro-N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-2-ylmethoxy)quinazolin-4-amine (PubChem CID 165415105) has the molecular formula C18H16ClN5O and a molecular weight of 353.81 g/mol. Its IUPAC name is 6-chloro-N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-2-ylmethoxy)quinazolin-4-amine.

Molecular Properties

Compound Name6-chloro-N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-2-ylmethoxy)quinazolin-4-amine
PubChem CID165415105
Molecular FormulaC18H16ClN5O
Molecular Weight353.81 g/mol
Exact Mass353.10
IUPAC Name6-chloro-N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-2-ylmethoxy)quinazolin-4-amine
SMILESCN(C)c1nc(OCc2cc3ccccn3n2)nc2ccc(Cl)cc12
InChIInChI=1S/C18H16ClN5O/c1-23(2)17-15-9-12(19)6-7-16(15)20-18(21-17)25-11-13-10-14-5-3-4-8-24(14)22-13/h3-10H,11H2,1-2H3
InChIKeyRBQXSZWTRKCCEI-UHFFFAOYSA-N
XLogP3.58
TPSA55.55 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.81
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-chloro-N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-2-ylmethoxy)quinazolin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-2-ylmethoxy)quinazolin-4-amine?
The IUPAC name of 6-chloro-N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-2-ylmethoxy)quinazolin-4-amine (CID 165415105) is 6-chloro-N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-2-ylmethoxy)quinazolin-4-amine.
What is the SMILES notation for 6-chloro-N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-2-ylmethoxy)quinazolin-4-amine?
The canonical SMILES for 6-chloro-N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-2-ylmethoxy)quinazolin-4-amine is CN(C)c1nc(OCc2cc3ccccn3n2)nc2ccc(Cl)cc12.
What is the InChIKey of 6-chloro-N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-2-ylmethoxy)quinazolin-4-amine?
The InChIKey is RBQXSZWTRKCCEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16ClN5O/c1-23(2)17-15-9-12(19)6-7-16(15)20-18(21-17)25-11-13-10-14-5-3-4-8-24(14)22-13/h3-10H,11H2,1-2H3.
What are the key properties of 6-chloro-N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-2-ylmethoxy)quinazolin-4-amine?
6-chloro-N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-2-ylmethoxy)quinazolin-4-amine has a molecular weight of 353.81 g/mol, XLogP of 3.58, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N,N-dimethyl-2-(pyrazolo[1,5-a]pyridin-2-ylmethoxy)quinazolin-4-amine is sourced from PubChem (CID 165415105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).