4-(4-chlorocinnolin-7-yl)morpholine

C12H12ClN3O — CID 164929970

IUPAC4-(4-chlorocinnolin-7-yl)morpholine
SMILESClc1cnnc2cc(N3CCOCC3)ccc12
InChIInChI=1S/C12H12ClN3O/c13-11-8-14-15-12-7-9(1-2-10(11)12)16-3-5-17-6-4-16/h1-2,7-8H,3-6H2
InChIKeyKFEAJVNFLKARJY-UHFFFAOYSA-N
MW249.70 g/mol
LogP2.12
Rot. Bonds1

About 4-(4-chlorocinnolin-7-yl)morpholine

4-(4-chlorocinnolin-7-yl)morpholine (PubChem CID 164929970) has the molecular formula C12H12ClN3O and a molecular weight of 249.70 g/mol. Its IUPAC name is 4-(4-chlorocinnolin-7-yl)morpholine.

Molecular Properties

Compound Name4-(4-chlorocinnolin-7-yl)morpholine
PubChem CID164929970
Molecular FormulaC12H12ClN3O
Molecular Weight249.70 g/mol
Exact Mass249.07
IUPAC Name4-(4-chlorocinnolin-7-yl)morpholine
SMILESClc1cnnc2cc(N3CCOCC3)ccc12
InChIInChI=1S/C12H12ClN3O/c13-11-8-14-15-12-7-9(1-2-10(11)12)16-3-5-17-6-4-16/h1-2,7-8H,3-6H2
InChIKeyKFEAJVNFLKARJY-UHFFFAOYSA-N
XLogP2.12
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.70
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-(4-chlorocinnolin-7-yl)morpholine with MolForge

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

Launch Full Analysis

Related Compounds

4-(1-methylphthalazin-6-yl)morpholine
CID 175916256
CID 88962202
CID 88962202
2-chloro-5-morpholin-4-ylphenol
CID 84679971
4-(2-chloro-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-7-yl)morpholine
CID 168922552
4-[2,3-bis(4-morpholin-4-ylphenyl)quinoxalin-6-yl]morpholine
CID 168665169
2-(4-methyl-7-morpholin-4-ylquinazolin-2-yl)guanidine
CID 155436329
4-chloro-2-morpholin-4-ylquinolin-7-ol
CID 137146829
4-(4-pyrrolidin-1-ylphenyl)morpholine
CID 67305085
4-(6,7-dimethoxycinnolin-4-yl)morpholine
CID 58674716
4-[2-chloro-3-(chloromethyl)quinolin-6-yl]morpholine
CID 55176340
4-[4-(7-bromo-4-chloro-1H-indazol-6-yl)phenyl]morpholine
CID 155413165
(5-methoxypyridazin-3-yl)-[1-(7-morpholin-4-yl-1,2,3-benzotriazin-4-yl)piperidin-3-yl]methanol
CID 123371313

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorocinnolin-7-yl)morpholine?
The IUPAC name of 4-(4-chlorocinnolin-7-yl)morpholine (CID 164929970) is 4-(4-chlorocinnolin-7-yl)morpholine.
What is the SMILES notation for 4-(4-chlorocinnolin-7-yl)morpholine?
The canonical SMILES for 4-(4-chlorocinnolin-7-yl)morpholine is Clc1cnnc2cc(N3CCOCC3)ccc12.
What is the InChIKey of 4-(4-chlorocinnolin-7-yl)morpholine?
The InChIKey is KFEAJVNFLKARJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClN3O/c13-11-8-14-15-12-7-9(1-2-10(11)12)16-3-5-17-6-4-16/h1-2,7-8H,3-6H2.
What are the key properties of 4-(4-chlorocinnolin-7-yl)morpholine?
4-(4-chlorocinnolin-7-yl)morpholine has a molecular weight of 249.70 g/mol, XLogP of 2.12, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorocinnolin-7-yl)morpholine is sourced from PubChem (CID 164929970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).