(2-hydrazinyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)hydrazine

C10H15N7 — CID 1399308

IUPAC(2-hydrazinyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)hydrazine
SMILESNNc1nc(NN)c2c3c([nH]c2n1)CCCC3
InChIInChI=1S/C10H15N7/c11-16-9-7-5-3-1-2-4-6(5)13-8(7)14-10(15-9)17-12/h1-4,11-12H2,(H3,13,14,15,16,17)
InChIKeyUYRZXDJAWDRCDM-UHFFFAOYSA-N
MW233.28 g/mol
LogP0.41
Rot. Bonds2

About (2-hydrazinyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)hydrazine

(2-hydrazinyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)hydrazine (PubChem CID 1399308) has the molecular formula C10H15N7 and a molecular weight of 233.28 g/mol. Its IUPAC name is (2-hydrazinyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)hydrazine.

Molecular Properties

Compound Name(2-hydrazinyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)hydrazine
PubChem CID1399308
Molecular FormulaC10H15N7
Molecular Weight233.28 g/mol
Exact Mass233.14
IUPAC Name(2-hydrazinyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)hydrazine
SMILESNNc1nc(NN)c2c3c([nH]c2n1)CCCC3
InChIInChI=1S/C10H15N7/c11-16-9-7-5-3-1-2-4-6(5)13-8(7)14-10(15-9)17-12/h1-4,11-12H2,(H3,13,14,15,16,17)
InChIKeyUYRZXDJAWDRCDM-UHFFFAOYSA-N
XLogP0.41
TPSA117.67 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 50.41
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5,6-Diphenyl-7h-Pyrrolo[2,3-D]pyrimidine-2,4-Diamine
CID 15761739
5-propyl-6,7,8,9-tetrahydro-3H-pyrazolo[3,4-c]isoquinolin-1-amine
CID 658209
5-(Methylsulfanyl)-8,9,10,11-tetrahydro-3H-tetrazolo[1',5':1,6]pyrimido[4,5-b]indole
CID 135449604
5,6-Dimethyl-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine
CID 13803177
5-methyl-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine
CID 917094
5,6-dimethyl-7H-pyrrolo(2,3-d)pyrimidin-4-amine
CID 13041142
5-ethyl-6,7,8,9-tetrahydro-3H-pyrazolo[3,4-c]isoquinolin-1-amine
CID 660145
5-Butyl-3,6,7,8-tetrahydrocyclopenta[d]pyrazolo[3,4-b]pyridin-1-amine
CID 660386
5-Isobutyl-3,6,7,8-tetrahydrocyclopenta[d]pyrazolo[3,4-b]pyridin-1-amine
CID 661709
5-Isopropyl-3,6,7,8-tetrahydrocyclopenta[d]pyrazolo[3,4-b]pyridin-1-amine
CID 661927
5-Propyl-3,6,7,8-tetrahydrocyclopenta[d]pyrazolo[3,4-b]pyridin-1-amine
CID 664932
5-propan-2-yl-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c]isoquinolin-1-amine
CID 658108

Frequently Asked Questions

What is the IUPAC name of (2-hydrazinyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)hydrazine?
The IUPAC name of (2-hydrazinyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)hydrazine (CID 1399308) is (2-hydrazinyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)hydrazine.
What is the SMILES notation for (2-hydrazinyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)hydrazine?
The canonical SMILES for (2-hydrazinyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)hydrazine is NNc1nc(NN)c2c3c([nH]c2n1)CCCC3.
What is the InChIKey of (2-hydrazinyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)hydrazine?
The InChIKey is UYRZXDJAWDRCDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N7/c11-16-9-7-5-3-1-2-4-6(5)13-8(7)14-10(15-9)17-12/h1-4,11-12H2,(H3,13,14,15,16,17).
What are the key properties of (2-hydrazinyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)hydrazine?
(2-hydrazinyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)hydrazine has a molecular weight of 233.28 g/mol, XLogP of 0.41, 2 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydrazinyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl)hydrazine is sourced from PubChem (CID 1399308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).