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

C10H8Cl2N4O — CID 14362435

IUPAC4-chloro-N-(4-chlorophenyl)-6-methoxy-1,3,5-triazin-2-amine
SMILESCOc1nc(Cl)nc(Nc2ccc(Cl)cc2)n1
InChIInChI=1S/C10H8Cl2N4O/c1-17-10-15-8(12)14-9(16-10)13-7-4-2-6(11)3-5-7/h2-5H,1H3,(H,13,14,15,16)
InChIKeyYLDXGRBMHUMILK-UHFFFAOYSA-N
MW271.11 g/mol
LogP2.93
Rot. Bonds3

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

4-chloro-N-(4-chlorophenyl)-6-methoxy-1,3,5-triazin-2-amine (PubChem CID 14362435) has the molecular formula C10H8Cl2N4O and a molecular weight of 271.11 g/mol. Its IUPAC name is 4-chloro-N-(4-chlorophenyl)-6-methoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-N-(4-chlorophenyl)-6-methoxy-1,3,5-triazin-2-amine
PubChem CID14362435
Molecular FormulaC10H8Cl2N4O
Molecular Weight271.11 g/mol
Exact Mass270.01
IUPAC Name4-chloro-N-(4-chlorophenyl)-6-methoxy-1,3,5-triazin-2-amine
SMILESCOc1nc(Cl)nc(Nc2ccc(Cl)cc2)n1
InChIInChI=1S/C10H8Cl2N4O/c1-17-10-15-8(12)14-9(16-10)13-7-4-2-6(11)3-5-7/h2-5H,1H3,(H,13,14,15,16)
InChIKeyYLDXGRBMHUMILK-UHFFFAOYSA-N
XLogP2.93
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.11
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino]phenol
CID 59860984
6-chloro-2-N,4-N-bis(4-methoxyphenyl)-1,3,5-triazine-2,4-diamine
CID 23191
4-chloro-N-(4-methoxyphenyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 62870184
4-chloro-N-(4-chloro-2-methylphenyl)-6-methoxy-1,3,5-triazin-2-amine
CID 114256288
N-(3-bromo-4-iodophenyl)-4-chloro-6-methoxy-1,3,5-triazin-2-amine
CID 114262303
2-N,6-N-bis(4-chloro-6-methoxy-1,3,5-triazin-2-yl)pyridine-2,6-diamine
CID 102286750
N-(3-chloro-4-fluorophenyl)-4,6-dimethoxy-1,3,5-triazin-2-amine
CID 62861592
4-chloro-N-(2,6-difluoro-3-methylphenyl)-6-methoxy-1,3,5-triazin-2-amine
CID 82819504
5-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino]isoindole-1,3-dione
CID 62858487
4-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-methoxy-1,3,5-triazin-2-amine
CID 62857159
N-(5-bromo-2-fluorophenyl)-4-chloro-6-methoxy-1,3,5-triazin-2-amine
CID 62859689
N-(4-fluorophenyl)-4,6-dimethoxy-1,3,5-triazin-2-amine
CID 2796483

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(4-chlorophenyl)-6-methoxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-N-(4-chlorophenyl)-6-methoxy-1,3,5-triazin-2-amine (CID 14362435) is 4-chloro-N-(4-chlorophenyl)-6-methoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-N-(4-chlorophenyl)-6-methoxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-N-(4-chlorophenyl)-6-methoxy-1,3,5-triazin-2-amine is COc1nc(Cl)nc(Nc2ccc(Cl)cc2)n1.
What is the InChIKey of 4-chloro-N-(4-chlorophenyl)-6-methoxy-1,3,5-triazin-2-amine?
The InChIKey is YLDXGRBMHUMILK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Cl2N4O/c1-17-10-15-8(12)14-9(16-10)13-7-4-2-6(11)3-5-7/h2-5H,1H3,(H,13,14,15,16).
What are the key properties of 4-chloro-N-(4-chlorophenyl)-6-methoxy-1,3,5-triazin-2-amine?
4-chloro-N-(4-chlorophenyl)-6-methoxy-1,3,5-triazin-2-amine has a molecular weight of 271.11 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(4-chlorophenyl)-6-methoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 14362435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).