N-methyl-4,5,6,7-tetrahydro-1H-indazol-3-amine

C8H13N3 — CID 45121266

IUPACN-methyl-4,5,6,7-tetrahydro-1H-indazol-3-amine
SMILESCNc1n[nH]c2c1CCCC2
InChIInChI=1S/C8H13N3/c1-9-8-6-4-2-3-5-7(6)10-11-8/h2-5H2,1H3,(H2,9,10,11)
InChIKeyZIVJQMJCCVNNCM-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.33
Rot. Bonds1

About N-methyl-4,5,6,7-tetrahydro-1H-indazol-3-amine

N-methyl-4,5,6,7-tetrahydro-1H-indazol-3-amine (PubChem CID 45121266) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is N-methyl-4,5,6,7-tetrahydro-1H-indazol-3-amine.

Molecular Properties

Compound NameN-methyl-4,5,6,7-tetrahydro-1H-indazol-3-amine
PubChem CID45121266
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC NameN-methyl-4,5,6,7-tetrahydro-1H-indazol-3-amine
SMILESCNc1n[nH]c2c1CCCC2
InChIInChI=1S/C8H13N3/c1-9-8-6-4-2-3-5-7(6)10-11-8/h2-5H2,1H3,(H2,9,10,11)
InChIKeyZIVJQMJCCVNNCM-UHFFFAOYSA-N
XLogP1.33
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-4,5,6,7-tetrahydro-1H-indazol-3-amine?
The IUPAC name of N-methyl-4,5,6,7-tetrahydro-1H-indazol-3-amine (CID 45121266) is N-methyl-4,5,6,7-tetrahydro-1H-indazol-3-amine.
What is the SMILES notation for N-methyl-4,5,6,7-tetrahydro-1H-indazol-3-amine?
The canonical SMILES for N-methyl-4,5,6,7-tetrahydro-1H-indazol-3-amine is CNc1n[nH]c2c1CCCC2.
What is the InChIKey of N-methyl-4,5,6,7-tetrahydro-1H-indazol-3-amine?
The InChIKey is ZIVJQMJCCVNNCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-9-8-6-4-2-3-5-7(6)10-11-8/h2-5H2,1H3,(H2,9,10,11).
What are the key properties of N-methyl-4,5,6,7-tetrahydro-1H-indazol-3-amine?
N-methyl-4,5,6,7-tetrahydro-1H-indazol-3-amine has a molecular weight of 151.21 g/mol, XLogP of 1.33, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4,5,6,7-tetrahydro-1H-indazol-3-amine is sourced from PubChem (CID 45121266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).