4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine

C11H12ClN5O — CID 114054128

IUPAC4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine
SMILESCOc1cccnc1-c1nc(Cl)nc(N(C)C)n1
InChIInChI=1S/C11H12ClN5O/c1-17(2)11-15-9(14-10(12)16-11)8-7(18-3)5-4-6-13-8/h4-6H,1-3H3
InChIKeyQBTBPMBUFDODKI-UHFFFAOYSA-N
MW265.70 g/mol
LogP1.66
Rot. Bonds3

About 4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine

4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine (PubChem CID 114054128) has the molecular formula C11H12ClN5O and a molecular weight of 265.70 g/mol. Its IUPAC name is 4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine
PubChem CID114054128
Molecular FormulaC11H12ClN5O
Molecular Weight265.70 g/mol
Exact Mass265.07
IUPAC Name4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine
SMILESCOc1cccnc1-c1nc(Cl)nc(N(C)C)n1
InChIInChI=1S/C11H12ClN5O/c1-17(2)11-15-9(14-10(12)16-11)8-7(18-3)5-4-6-13-8/h4-6H,1-3H3
InChIKeyQBTBPMBUFDODKI-UHFFFAOYSA-N
XLogP1.66
TPSA64.03 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.70
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine with MolForge

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Related Compounds

4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine
CID 81221970
2-(4-chlorophenyl)-3-methoxypyridine
CID 90122541
4-chloro-6-(2-methoxy-3,4-dimethylphenyl)-N,N-dimethyl-1,3,5-triazin-2-amine
CID 103434427
6-chloro-4-N-[(2-methoxyphenyl)methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 62869536
4-chloro-N,N-dimethyl-6-(2-methylphenoxy)-1,3,5-triazin-2-amine
CID 62869628
3,5-dichloro-6-(3-methoxy-2-pyridinyl)pyridin-2-amine
CID 114054154
2-(2,3-dichlorophenyl)-3-methoxypyridine
CID 90122655
6-(2,6-dimethoxyphenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 116811235
4-(3-bromophenyl)-6-chloro-N,N-dimethyl-1,3,5-triazin-2-amine
CID 115503898
3-methoxy-2-(4-propan-2-ylphenyl)pyridine
CID 135075051
4-chloro-6-(3-methoxy-2-pyridinyl)-2-propan-2-ylpyrimidine
CID 114054131
6-chloro-2-N-(3-methoxyphenyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 62863477

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine (CID 114054128) is 4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine is COc1cccnc1-c1nc(Cl)nc(N(C)C)n1.
What is the InChIKey of 4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine?
The InChIKey is QBTBPMBUFDODKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN5O/c1-17(2)11-15-9(14-10(12)16-11)8-7(18-3)5-4-6-13-8/h4-6H,1-3H3.
What are the key properties of 4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine?
4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine has a molecular weight of 265.70 g/mol, XLogP of 1.66, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 114054128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).