1-methyl-3a,7a-dihydroindazol-4-amine

C8H11N3 — CID 112711869

IUPAC1-methyl-3a,7a-dihydroindazol-4-amine
SMILESCN1N=CC2C(N)=CC=CC21
InChIInChI=1S/C8H11N3/c1-11-8-4-2-3-7(9)6(8)5-10-11/h2-6,8H,9H2,1H3
InChIKeyVBABMNHBWHBBRO-UHFFFAOYSA-N
MW149.20 g/mol
LogP0.31
Rot. Bonds

About 1-methyl-3a,7a-dihydroindazol-4-amine

1-methyl-3a,7a-dihydroindazol-4-amine (PubChem CID 112711869) has the molecular formula C8H11N3 and a molecular weight of 149.20 g/mol. Its IUPAC name is 1-methyl-3a,7a-dihydroindazol-4-amine.

Molecular Properties

Compound Name1-methyl-3a,7a-dihydroindazol-4-amine
PubChem CID112711869
Molecular FormulaC8H11N3
Molecular Weight149.20 g/mol
Exact Mass149.10
IUPAC Name1-methyl-3a,7a-dihydroindazol-4-amine
SMILESCN1N=CC2C(N)=CC=CC21
InChIInChI=1S/C8H11N3/c1-11-8-4-2-3-7(9)6(8)5-10-11/h2-6,8H,9H2,1H3
InChIKeyVBABMNHBWHBBRO-UHFFFAOYSA-N
XLogP0.31
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.20
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Methyl-3a,7a-dihydroindazole
CID 19426256
1-methyl-N-(2-methylpropyl)-N-propyl-3a,7a-dihydroindazol-5-amine
CID 59514039
3a,7a-dihydro-1H-indazol-4-amine
CID 69191563
N-(2-methylpropyl)-N-propyl-3a,7a-dihydro-1H-indazol-5-amine
CID 70841009
1,6-Dimethyl-3a,7a-dihydroindazole
CID 89669477
1-Methyl-3a,7a-dihydroindazole-4,7-diamine
CID 90145931
1-Methyl-3a,7a-dihydroindazol-7-amine
CID 112711871
3,5-Dimethyl-3,3a-dihydropyrazolo[1,5-a]pyridine
CID 123942194
4-methyl-3a,4-dihydro-1H-indazole
CID 129043487
3-Methyl-3,3a-dihydropyrazolo[1,5-a]pyridine
CID 134448019
(1Z,3Z)-1-(2-methyl-3,4-dihydropyrazol-3-yl)hexa-1,3,5-trien-1-amine
CID 141787126
1,5-Dimethyl-3a,7a-dihydroindazole
CID 143670863

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3a,7a-dihydroindazol-4-amine?
The IUPAC name of 1-methyl-3a,7a-dihydroindazol-4-amine (CID 112711869) is 1-methyl-3a,7a-dihydroindazol-4-amine.
What is the SMILES notation for 1-methyl-3a,7a-dihydroindazol-4-amine?
The canonical SMILES for 1-methyl-3a,7a-dihydroindazol-4-amine is CN1N=CC2C(N)=CC=CC21.
What is the InChIKey of 1-methyl-3a,7a-dihydroindazol-4-amine?
The InChIKey is VBABMNHBWHBBRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3/c1-11-8-4-2-3-7(9)6(8)5-10-11/h2-6,8H,9H2,1H3.
What are the key properties of 1-methyl-3a,7a-dihydroindazol-4-amine?
1-methyl-3a,7a-dihydroindazol-4-amine has a molecular weight of 149.20 g/mol, XLogP of 0.31, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3a,7a-dihydroindazol-4-amine is sourced from PubChem (CID 112711869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).