6-N-cyclopenta-1,4-dien-1-yl-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine

C10H15N5 — CID 157171984

IUPAC6-N-cyclopenta-1,4-dien-1-yl-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine
SMILESCC1N=C(N)NC(N(C)C2=CCC=C2)=N1
InChIInChI=1S/C10H15N5/c1-7-12-9(11)14-10(13-7)15(2)8-5-3-4-6-8/h3,5-7H,4H2,1-2H3,(H3,11,12,13,14)
InChIKeyVCCJFYLJLLICEV-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.38
Rot. Bonds1

About 6-N-cyclopenta-1,4-dien-1-yl-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine

6-N-cyclopenta-1,4-dien-1-yl-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine (PubChem CID 157171984) has the molecular formula C10H15N5 and a molecular weight of 205.26 g/mol. Its IUPAC name is 6-N-cyclopenta-1,4-dien-1-yl-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine.

Molecular Properties

Compound Name6-N-cyclopenta-1,4-dien-1-yl-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine
PubChem CID157171984
Molecular FormulaC10H15N5
Molecular Weight205.26 g/mol
Exact Mass205.13
IUPAC Name6-N-cyclopenta-1,4-dien-1-yl-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine
SMILESCC1N=C(N)NC(N(C)C2=CCC=C2)=N1
InChIInChI=1S/C10H15N5/c1-7-12-9(11)14-10(13-7)15(2)8-5-3-4-6-8/h3,5-7H,4H2,1-2H3,(H3,11,12,13,14)
InChIKeyVCCJFYLJLLICEV-UHFFFAOYSA-N
XLogP0.38
TPSA66.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-N-cyclopenta-1,4-dien-1-yl-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine with MolForge

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Related Compounds

4-[3,3-difluoro-4-(methylideneamino)-5-[(Z)-prop-1-enyl]-2H-pyrrol-1-yl]-N-methyl-1,3-diaza-5-azoniacyclohexa-4,5,6-trien-2-imine
CID 176521151
1-(4-methylbenzene-5-id-1-yl)-2H-1,3,5-triazine-4,6-diamine;yttrium
CID 59107798
4-N-[(2E,4Z)-hepta-2,4-dien-3-yl]-4-N,6-N,6-N,2,5-pentamethyl-2H-1,3,5-triazine-4,6-diamine
CID 89682679
1-Cyclohexa-1,5-dien-1-yl-2-methylguanidine
CID 143088471
1-Cyclohepta-1,3,6-trien-1-yl-3-(diaminomethylidene)-2-methylguanidine
CID 145606983
1-methyl-5-[(Z)-prop-1-enyl]-7,8-dihydroimidazo[1,2-a][1,3]diazepine
CID 146531975
1-Cyclohepta-1,4,6-trien-1-yl-3-ethyl-1,2-dimethylguanidine
CID 146532026
N-methyl-1-[(3,4,6-trimethyl-1,4-dihydropyrimidin-2-ylidene)amino]methanamine
CID 146777793
1-Carbamimidoyl-2-cyclopenta-1,4-dien-1-yl-1-methylguanidine
CID 157078722
1-[Amino-(cyclopenta-1,4-dien-1-ylamino)methylidene]-2-methylguanidine
CID 157078723
1-Cyclopenta-1,4-dien-1-yl-3-(diaminomethylidene)-2-methylguanidine
CID 157078724
1-Cyclopenta-1,4-dien-1-yl-3-(diaminomethylidene)-1-methylguanidine
CID 157078725

Frequently Asked Questions

What is the IUPAC name of 6-N-cyclopenta-1,4-dien-1-yl-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine?
The IUPAC name of 6-N-cyclopenta-1,4-dien-1-yl-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine (CID 157171984) is 6-N-cyclopenta-1,4-dien-1-yl-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine.
What is the SMILES notation for 6-N-cyclopenta-1,4-dien-1-yl-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine?
The canonical SMILES for 6-N-cyclopenta-1,4-dien-1-yl-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine is CC1N=C(N)NC(N(C)C2=CCC=C2)=N1.
What is the InChIKey of 6-N-cyclopenta-1,4-dien-1-yl-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine?
The InChIKey is VCCJFYLJLLICEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5/c1-7-12-9(11)14-10(13-7)15(2)8-5-3-4-6-8/h3,5-7H,4H2,1-2H3,(H3,11,12,13,14).
What are the key properties of 6-N-cyclopenta-1,4-dien-1-yl-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine?
6-N-cyclopenta-1,4-dien-1-yl-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine has a molecular weight of 205.26 g/mol, XLogP of 0.38, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-cyclopenta-1,4-dien-1-yl-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine is sourced from PubChem (CID 157171984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).