6-chloro-2-N,4-N-bis(ethenyl)-1,3,5-triazine-2,4-diamine

C7H8ClN5 — CID 119094423

IUPAC6-chloro-2-N,4-N-bis(ethenyl)-1,3,5-triazine-2,4-diamine
SMILESC=CNc1nc(Cl)nc(NC=C)n1
InChIInChI=1S/C7H8ClN5/c1-3-9-6-11-5(8)12-7(13-6)10-4-2/h3-4H,1-2H2,(H2,9,10,11,12,13)
InChIKeyWDPDHNWIQDWJJA-UHFFFAOYSA-N
MW197.63 g/mol
LogP1.64
Rot. Bonds4

About 6-chloro-2-N,4-N-bis(ethenyl)-1,3,5-triazine-2,4-diamine

6-chloro-2-N,4-N-bis(ethenyl)-1,3,5-triazine-2,4-diamine (PubChem CID 119094423) has the molecular formula C7H8ClN5 and a molecular weight of 197.63 g/mol. Its IUPAC name is 6-chloro-2-N,4-N-bis(ethenyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-chloro-2-N,4-N-bis(ethenyl)-1,3,5-triazine-2,4-diamine
PubChem CID119094423
Molecular FormulaC7H8ClN5
Molecular Weight197.63 g/mol
Exact Mass197.05
IUPAC Name6-chloro-2-N,4-N-bis(ethenyl)-1,3,5-triazine-2,4-diamine
SMILESC=CNc1nc(Cl)nc(NC=C)n1
InChIInChI=1S/C7H8ClN5/c1-3-9-6-11-5(8)12-7(13-6)10-4-2/h3-4H,1-2H2,(H2,9,10,11,12,13)
InChIKeyWDPDHNWIQDWJJA-UHFFFAOYSA-N
XLogP1.64
TPSA62.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.63
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine
CID 57438000
6-chloro-2-N,4-N-bis(hex-5-enyl)-1,3,5-triazine-2,4-diamine
CID 101229509
6-chloro-4-N-methyl-2-N-prop-2-enyl-1,3,5-triazine-2,4-diamine
CID 54353580
6-chloro-2-N,4-N-diethyl-1,3,5-triazine-2,4-diamine
CID 19377260
6-chloro-2-N,4-N-diethyl-(1,3,5-15N3)1,3,5-triazine-2,4-diamine
CID 91927796
6-chloro-2-N,4-N-diethyl-1,3,5-triazine-2,4-diamine
CID 5216
6-chloro-2-N-(2-methylprop-2-enyl)-4-N-prop-2-enyl-1,3,5-triazine-2,4-diamine
CID 15729053
N-(4,6-dichloro-1,3,5-triazin-2-yl)hydroxylamine
CID 89401722
2-N-ethenylpyrimidine-2,5-diamine
CID 6917251
butane;6-chloro-2-N,4-N-diethyl-1,3,5-triazine-2,4-diamine
CID 87719227
2-chloro-N,5-bis(ethenyl)-1H-imidazol-4-amine
CID 143405177
N-(2-but-3-enoxyethyl)-4,6-dichloro-1,3,5-triazin-2-amine
CID 106405801

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-N,4-N-bis(ethenyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-chloro-2-N,4-N-bis(ethenyl)-1,3,5-triazine-2,4-diamine (CID 119094423) is 6-chloro-2-N,4-N-bis(ethenyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-chloro-2-N,4-N-bis(ethenyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-chloro-2-N,4-N-bis(ethenyl)-1,3,5-triazine-2,4-diamine is C=CNc1nc(Cl)nc(NC=C)n1.
What is the InChIKey of 6-chloro-2-N,4-N-bis(ethenyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is WDPDHNWIQDWJJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClN5/c1-3-9-6-11-5(8)12-7(13-6)10-4-2/h3-4H,1-2H2,(H2,9,10,11,12,13).
What are the key properties of 6-chloro-2-N,4-N-bis(ethenyl)-1,3,5-triazine-2,4-diamine?
6-chloro-2-N,4-N-bis(ethenyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 197.63 g/mol, XLogP of 1.64, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-N,4-N-bis(ethenyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 119094423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).