N-(6-methoxy-3-pyridinyl)-2-methyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine

C16H15N5OS — CID 11381775

IUPACN-(6-methoxy-3-pyridinyl)-2-methyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine
SMILESCOc1ccc(Nc2ncc3c(n2)-c2sc(C)nc2CC3)cn1
InChIInChI=1S/C16H15N5OS/c1-9-19-12-5-3-10-7-18-16(21-14(10)15(12)23-9)20-11-4-6-13(22-2)17-8-11/h4,6-8H,3,5H2,1-2H3,(H,18,20,21)
InChIKeyJILRFQCHFBJCKL-UHFFFAOYSA-N
MW325.40 g/mol
LogP3.15
Rot. Bonds3

About N-(6-methoxy-3-pyridinyl)-2-methyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine

N-(6-methoxy-3-pyridinyl)-2-methyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine (PubChem CID 11381775) has the molecular formula C16H15N5OS and a molecular weight of 325.40 g/mol. Its IUPAC name is N-(6-methoxy-3-pyridinyl)-2-methyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine.

Molecular Properties

Compound NameN-(6-methoxy-3-pyridinyl)-2-methyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine
PubChem CID11381775
Molecular FormulaC16H15N5OS
Molecular Weight325.40 g/mol
Exact Mass325.10
IUPAC NameN-(6-methoxy-3-pyridinyl)-2-methyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine
SMILESCOc1ccc(Nc2ncc3c(n2)-c2sc(C)nc2CC3)cn1
InChIInChI=1S/C16H15N5OS/c1-9-19-12-5-3-10-7-18-16(21-14(10)15(12)23-9)20-11-4-6-13(22-2)17-8-11/h4,6-8H,3,5H2,1-2H3,(H,18,20,21)
InChIKeyJILRFQCHFBJCKL-UHFFFAOYSA-N
XLogP3.15
TPSA72.82 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.40
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(6-methoxy-3-pyridinyl)-2-methyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine with MolForge

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Related Compounds

4-(2-Methyl-4,5-dihydro-thiazolo[4,5-h]quinazolin-8-ylamino)-phenol
CID 11266891
3-(2-Methyl-4,5-dihydro-thiazolo[4,5-h]quinazolin-8-ylamino)-phenol
CID 11289869
1-Ethyl-3-(5-methoxy-6-pyrimidin-5-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)urea
CID 59352810
N-(4-methoxyphenyl)-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-6-amine
CID 71460338
5-N-[(3-methoxyphenyl)methyl]-2-pyrazin-2-yl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-diamine
CID 145960746
5-N-[(2-methoxyphenyl)methyl]-2-pyrazin-2-yl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-diamine
CID 145961748
4-[4-(4-fluorophenyl)-2-piperidin-4-yl-1,3-thiazol-5-yl]-N-(2-methoxy-6-methyl-4-pyridinyl)pyrimidin-2-amine
CID 155541728
N-(4-methoxyphenyl)-9-thia-3,5,11-triazatricyclo[8.4.0.02,7]tetradeca-1(10),2,4,6,11,13-hexaen-4-amine
CID 155566059
6-(1,3-benzothiazol-6-yl)-N-[1-(2-methoxy-4-pyridinyl)ethyl]-2-methylpyrimidin-4-amine
CID 123919848
N-(4-(pyridin-4-ylmethoxy)phenyl)-4-(thiazol-2-yl)pyrimidin-2-amine
CID 44565736
(2S)-1-N-[7-(2-methoxy-3-pyridinyl)-6-methyl-2-pyridin-4-ylthieno[3,2-d]pyrimidin-4-yl]-3-phenylpropane-1,2-diamine
CID 89596593
N-(4-methoxyphenyl)-8-thia-3,5,10,13-tetrazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaen-6-amine
CID 71460340

Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-3-pyridinyl)-2-methyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine?
The IUPAC name of N-(6-methoxy-3-pyridinyl)-2-methyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine (CID 11381775) is N-(6-methoxy-3-pyridinyl)-2-methyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine.
What is the SMILES notation for N-(6-methoxy-3-pyridinyl)-2-methyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine?
The canonical SMILES for N-(6-methoxy-3-pyridinyl)-2-methyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine is COc1ccc(Nc2ncc3c(n2)-c2sc(C)nc2CC3)cn1.
What is the InChIKey of N-(6-methoxy-3-pyridinyl)-2-methyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine?
The InChIKey is JILRFQCHFBJCKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5OS/c1-9-19-12-5-3-10-7-18-16(21-14(10)15(12)23-9)20-11-4-6-13(22-2)17-8-11/h4,6-8H,3,5H2,1-2H3,(H,18,20,21).
What are the key properties of N-(6-methoxy-3-pyridinyl)-2-methyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine?
N-(6-methoxy-3-pyridinyl)-2-methyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine has a molecular weight of 325.40 g/mol, XLogP of 3.15, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-3-pyridinyl)-2-methyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine is sourced from PubChem (CID 11381775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).