7-chloro-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine

C14H17ClN4O3S — CID 133278645

IUPAC7-chloro-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine
SMILESO=S(=O)(CCNc1ncnc2cc(Cl)ccc12)N1CCOCC1
InChIInChI=1S/C14H17ClN4O3S/c15-11-1-2-12-13(9-11)17-10-18-14(12)16-3-8-23(20,21)19-4-6-22-7-5-19/h1-2,9-10H,3-8H2,(H,16,17,18)
InChIKeyGWUIJEOKYFGWSS-UHFFFAOYSA-N
MW356.84 g/mol
LogP1.36
Rot. Bonds5

About 7-chloro-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine

7-chloro-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine (PubChem CID 133278645) has the molecular formula C14H17ClN4O3S and a molecular weight of 356.84 g/mol. Its IUPAC name is 7-chloro-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine.

Molecular Properties

Compound Name7-chloro-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine
PubChem CID133278645
Molecular FormulaC14H17ClN4O3S
Molecular Weight356.84 g/mol
Exact Mass356.07
IUPAC Name7-chloro-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine
SMILESO=S(=O)(CCNc1ncnc2cc(Cl)ccc12)N1CCOCC1
InChIInChI=1S/C14H17ClN4O3S/c15-11-1-2-12-13(9-11)17-10-18-14(12)16-3-8-23(20,21)19-4-6-22-7-5-19/h1-2,9-10H,3-8H2,(H,16,17,18)
InChIKeyGWUIJEOKYFGWSS-UHFFFAOYSA-N
XLogP1.36
TPSA84.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.84
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-chloro-N-(2-morpholin-4-ylethyl)quinazolin-4-amine
CID 70854811
7-chloro-N-(1-methylsulfonylpiperidin-4-yl)quinazolin-4-amine
CID 24632856
1-[4-[2-[(7-chloroquinazolin-4-yl)amino]ethyl]piperazin-1-yl]ethanone
CID 87014727
N-(2-morpholin-4-ylsulfonylethyl)-7-(trifluoromethyl)quinolin-4-amine
CID 133405255
3-[5-[(7-chloroquinazolin-4-yl)amino]pentyl]imidazolidine-2,4-dione
CID 167200226
7-chloro-N-(3-methylbutyl)quinazolin-4-amine;ethane
CID 156733545
4-N-(2-methylsulfonylethyl)quinazoline-4,7-diamine
CID 65337012
1-(azetidin-1-yl)-2-[(7-chloroquinazolin-4-yl)amino]ethanone;difluoromethane
CID 178127443
3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one
CID 72849237
2-(4-methoxyphenyl)-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine
CID 171356984
7-chloro-N-[2-(2-fluorophenyl)ethyl]quinazolin-4-amine
CID 91647410
ethyl 3-[(7-chloroquinazolin-4-yl)amino]propanoate
CID 51126402

Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine?
The IUPAC name of 7-chloro-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine (CID 133278645) is 7-chloro-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine.
What is the SMILES notation for 7-chloro-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine?
The canonical SMILES for 7-chloro-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine is O=S(=O)(CCNc1ncnc2cc(Cl)ccc12)N1CCOCC1.
What is the InChIKey of 7-chloro-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine?
The InChIKey is GWUIJEOKYFGWSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN4O3S/c15-11-1-2-12-13(9-11)17-10-18-14(12)16-3-8-23(20,21)19-4-6-22-7-5-19/h1-2,9-10H,3-8H2,(H,16,17,18).
What are the key properties of 7-chloro-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine?
7-chloro-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine has a molecular weight of 356.84 g/mol, XLogP of 1.36, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine is sourced from PubChem (CID 133278645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).