N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-6-methylquinazolin-4-amine

C15H16N4S — CID 133428294

IUPACN-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-6-methylquinazolin-4-amine
SMILESCc1ccc2ncnc(NCc3nc(C)c(C)s3)c2c1
InChIInChI=1S/C15H16N4S/c1-9-4-5-13-12(6-9)15(18-8-17-13)16-7-14-19-10(2)11(3)20-14/h4-6,8H,7H2,1-3H3,(H,16,17,18)
InChIKeyYZNHPVFYEAROFC-UHFFFAOYSA-N
MW284.39 g/mol
LogP3.62
Rot. Bonds3

About N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-6-methylquinazolin-4-amine

N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-6-methylquinazolin-4-amine (PubChem CID 133428294) has the molecular formula C15H16N4S and a molecular weight of 284.39 g/mol. Its IUPAC name is N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-6-methylquinazolin-4-amine.

Molecular Properties

Compound NameN-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-6-methylquinazolin-4-amine
PubChem CID133428294
Molecular FormulaC15H16N4S
Molecular Weight284.39 g/mol
Exact Mass284.11
IUPAC NameN-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-6-methylquinazolin-4-amine
SMILESCc1ccc2ncnc(NCc3nc(C)c(C)s3)c2c1
InChIInChI=1S/C15H16N4S/c1-9-4-5-13-12(6-9)15(18-8-17-13)16-7-14-19-10(2)11(3)20-14/h4-6,8H,7H2,1-3H3,(H,16,17,18)
InChIKeyYZNHPVFYEAROFC-UHFFFAOYSA-N
XLogP3.62
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.39
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-methyl-N-(2-methyl-2-methylsulfanylpropyl)quinazolin-4-amine
CID 133327399
N-tert-butyl-6-methylquinazolin-4-amine
CID 21002439
6-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]quinazolin-4-amine
CID 91641684
N-[(6-bromoimidazo[1,2-a]pyridin-2-yl)methyl]-6-methylquinazolin-4-amine
CID 133269867
N-[2-(5-chlorothiophen-2-yl)ethyl]-6-methylquinazolin-4-amine
CID 112843876
5-[[(6-methylquinazolin-4-yl)amino]methyl]-1,3-dihydrobenzimidazol-2-one
CID 166209245
6-methyl-N-(4-methylphenyl)quinazolin-4-amine
CID 5328827
3-fluoro-4-[[(6-methylquinazolin-4-yl)amino]methyl]benzonitrile
CID 99814684
6-methyl-N-[(1-phenylpyrazol-3-yl)methyl]quinazolin-4-amine
CID 133277823
4-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]quinazoline-4,6-diamine
CID 106369899
methyl 2,2-dimethyl-3-[(6-methylquinazolin-4-yl)amino]propanoate
CID 133429933
5-methyl-N-[2-[(6-methylquinazolin-4-yl)amino]ethyl]thiophene-2-sulfonamide
CID 133395378

Frequently Asked Questions

What is the IUPAC name of N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-6-methylquinazolin-4-amine?
The IUPAC name of N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-6-methylquinazolin-4-amine (CID 133428294) is N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-6-methylquinazolin-4-amine.
What is the SMILES notation for N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-6-methylquinazolin-4-amine?
The canonical SMILES for N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-6-methylquinazolin-4-amine is Cc1ccc2ncnc(NCc3nc(C)c(C)s3)c2c1.
What is the InChIKey of N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-6-methylquinazolin-4-amine?
The InChIKey is YZNHPVFYEAROFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4S/c1-9-4-5-13-12(6-9)15(18-8-17-13)16-7-14-19-10(2)11(3)20-14/h4-6,8H,7H2,1-3H3,(H,16,17,18).
What are the key properties of N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-6-methylquinazolin-4-amine?
N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-6-methylquinazolin-4-amine has a molecular weight of 284.39 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-6-methylquinazolin-4-amine is sourced from PubChem (CID 133428294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).