1,8,15-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-2,7,9,14-tetraen-2-amine

C12H14N4 — CID 3163254

IUPAC1,8,15-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-2,7,9,14-tetraen-2-amine
SMILESNc1c2c(nc3c4c(nn13)CCC4)CCC2
InChIInChI=1S/C12H14N4/c13-11-7-3-1-5-9(7)14-12-8-4-2-6-10(8)15-16(11)12/h1-6,13H2
InChIKeyDKJLZDLLDSQAOK-UHFFFAOYSA-N
MW214.27 g/mol
LogP1.29
Rot. Bonds

About 1,8,15-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-2,7,9,14-tetraen-2-amine

1,8,15-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-2,7,9,14-tetraen-2-amine (PubChem CID 3163254) has the molecular formula C12H14N4 and a molecular weight of 214.27 g/mol. Its IUPAC name is 1,8,15-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-2,7,9,14-tetraen-2-amine.

Molecular Properties

Compound Name1,8,15-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-2,7,9,14-tetraen-2-amine
PubChem CID3163254
Molecular FormulaC12H14N4
Molecular Weight214.27 g/mol
Exact Mass214.12
IUPAC Name1,8,15-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-2,7,9,14-tetraen-2-amine
SMILESNc1c2c(nc3c4c(nn13)CCC4)CCC2
InChIInChI=1S/C12H14N4/c13-11-7-3-1-5-9(7)14-12-8-4-2-6-10(8)15-16(11)12/h1-6,13H2
InChIKeyDKJLZDLLDSQAOK-UHFFFAOYSA-N
XLogP1.29
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1,8,15-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-2,7,9,14-tetraen-2-amine with MolForge

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Related Compounds

2,5-dimethyl-7,8-dihydro-6H-cyclopenta[e]pyrazolo[1,5-a]pyrimidine
CID 1477871
3-chloro-2,5-dimethyl-7,8-dihydro-6H-cyclopenta[e]pyrazolo[1,5-a]pyrimidine
CID 1477880
3-bromo-2,5-dimethyl-7,8-dihydro-6H-cyclopenta[e]pyrazolo[1,5-a]pyrimidine
CID 1477882
Pyrazolo(1,5-a)-1,3,5-triazine-2,4-diamine, 7-ethyl-8-methyl-, hydrochloride, hydrate
CID 3054720
6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-amine
CID 8741413
N-prop-2-ynyl-1,8,10,12-tetrazatricyclo[7.3.0.03,7]dodeca-2,7,9,11-tetraen-2-amine
CID 43816949
2-tert-butyl-5-methyl-7,8-dihydro-6H-cyclopenta(e)pyrazolo(1,5-a)pyrimidine
CID 91406043
2-Ethyl-3,5,6,7-tetramethyl-pyrazolo[1,5-a]pyrimidine
CID 703981
2,4-Diamino-7-(cyanomethyl)pyrazolo[1,5-a][1,3,5]triazine-8-carbonitrile
CID 163183539
7-Ethyl-8-methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine
CID 3054721
[11-(Trifluoromethyl)-1,8,12-triazatricyclo[7.3.0.03,7]dodeca-2,7,9,11-tetraen-2-yl]hydrazine
CID 82270466
5-Ethyl-2-fluoro-6-methylpyrazolo[1,5-a]pyrimidin-7-amine
CID 129939228

Frequently Asked Questions

What is the IUPAC name of 1,8,15-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-2,7,9,14-tetraen-2-amine?
The IUPAC name of 1,8,15-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-2,7,9,14-tetraen-2-amine (CID 3163254) is 1,8,15-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-2,7,9,14-tetraen-2-amine.
What is the SMILES notation for 1,8,15-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-2,7,9,14-tetraen-2-amine?
The canonical SMILES for 1,8,15-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-2,7,9,14-tetraen-2-amine is Nc1c2c(nc3c4c(nn13)CCC4)CCC2.
What is the InChIKey of 1,8,15-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-2,7,9,14-tetraen-2-amine?
The InChIKey is DKJLZDLLDSQAOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4/c13-11-7-3-1-5-9(7)14-12-8-4-2-6-10(8)15-16(11)12/h1-6,13H2.
What are the key properties of 1,8,15-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-2,7,9,14-tetraen-2-amine?
1,8,15-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-2,7,9,14-tetraen-2-amine has a molecular weight of 214.27 g/mol, XLogP of 1.29, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8,15-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-2,7,9,14-tetraen-2-amine is sourced from PubChem (CID 3163254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).