4-(6-methyl-4-methylsulfanylquinazolin-2-yl)morpholine

C14H17N3OS — CID 3849273

IUPAC4-(6-methyl-4-methylsulfanylquinazolin-2-yl)morpholine
SMILESCSc1nc(N2CCOCC2)nc2ccc(C)cc12
InChIInChI=1S/C14H17N3OS/c1-10-3-4-12-11(9-10)13(19-2)16-14(15-12)17-5-7-18-8-6-17/h3-4,9H,5-8H2,1-2H3
InChIKeyMPKBEPXLWDCNKR-UHFFFAOYSA-N
MW275.38 g/mol
LogP2.50
Rot. Bonds2

About 4-(6-methyl-4-methylsulfanylquinazolin-2-yl)morpholine

4-(6-methyl-4-methylsulfanylquinazolin-2-yl)morpholine (PubChem CID 3849273) has the molecular formula C14H17N3OS and a molecular weight of 275.38 g/mol. Its IUPAC name is 4-(6-methyl-4-methylsulfanylquinazolin-2-yl)morpholine.

Molecular Properties

Compound Name4-(6-methyl-4-methylsulfanylquinazolin-2-yl)morpholine
PubChem CID3849273
Molecular FormulaC14H17N3OS
Molecular Weight275.38 g/mol
Exact Mass275.11
IUPAC Name4-(6-methyl-4-methylsulfanylquinazolin-2-yl)morpholine
SMILESCSc1nc(N2CCOCC2)nc2ccc(C)cc12
InChIInChI=1S/C14H17N3OS/c1-10-3-4-12-11(9-10)13(19-2)16-14(15-12)17-5-7-18-8-6-17/h3-4,9H,5-8H2,1-2H3
InChIKeyMPKBEPXLWDCNKR-UHFFFAOYSA-N
XLogP2.50
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

5-(4-Morpholin-4-Yl-Phenylsulfanyl)-2,4-Quinazolinediamine
CID 3534
(R)-4-(4-methyl-5-(6-(2-(2-methylpyrrolidin-1-yl)ethyl)quinolin-2-yl)thiazol-2-yl)morpholine
CID 11669001
Diethyl-(2-morpholin-4-yl-quinazolin-4-yl)-amine
CID 6457762
2-(2-Cyclopropyl-quinazolin-4-ylsulfanyl)-1-(4-methyl-piperidin-1-yl)-ethanone
CID 856987
2-(2-Cyclopropylquinazolin-4-yl)sulfanyl-1-piperidin-1-ylethanone
CID 1435085
4-(2-Thiophen-2-ylquinazolin-4-yl)morpholine
CID 2570600
4,8-dimethyl-N-[3-(3-morpholin-4-ylpropyl)-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine
CID 666009
(2-Ethyl-quinazolin-4-ylsulfanyl)-acetic acid ethyl ester
CID 654420
2-(Methylsulfanyl)-4-morpholinoquinazoline
CID 658307
2-(2-tert-Butyl-quinazolin-4-ylsulfanyl)-N-(4-morpholin-4-yl-phenyl)-acetamide
CID 1442464
N-(4-Morpholin-4-yl-phenyl)-2-(2-propyl-quinazolin-4-ylsulfanyl)-acetamide
CID 1442655
N-butan-2-yl-3-(2-methoxyethyl)-7-methyl-4H-[1,3]thiazino[6,5-b]quinolin-2-imine
CID 3221534

Frequently Asked Questions

What is the IUPAC name of 4-(6-methyl-4-methylsulfanylquinazolin-2-yl)morpholine?
The IUPAC name of 4-(6-methyl-4-methylsulfanylquinazolin-2-yl)morpholine (CID 3849273) is 4-(6-methyl-4-methylsulfanylquinazolin-2-yl)morpholine.
What is the SMILES notation for 4-(6-methyl-4-methylsulfanylquinazolin-2-yl)morpholine?
The canonical SMILES for 4-(6-methyl-4-methylsulfanylquinazolin-2-yl)morpholine is CSc1nc(N2CCOCC2)nc2ccc(C)cc12.
What is the InChIKey of 4-(6-methyl-4-methylsulfanylquinazolin-2-yl)morpholine?
The InChIKey is MPKBEPXLWDCNKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3OS/c1-10-3-4-12-11(9-10)13(19-2)16-14(15-12)17-5-7-18-8-6-17/h3-4,9H,5-8H2,1-2H3.
What are the key properties of 4-(6-methyl-4-methylsulfanylquinazolin-2-yl)morpholine?
4-(6-methyl-4-methylsulfanylquinazolin-2-yl)morpholine has a molecular weight of 275.38 g/mol, XLogP of 2.50, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methyl-4-methylsulfanylquinazolin-2-yl)morpholine is sourced from PubChem (CID 3849273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).