methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)azanium

C9H16N3+ — CID 7236612

IUPACmethyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)azanium
SMILESC[NH2+]Cc1n[nH]c2c1CCCC2
InChIInChI=1S/C9H15N3/c1-10-6-9-7-4-2-3-5-8(7)11-12-9/h10H,2-6H2,1H3,(H,11,12)/p+1
InChIKeyCPHCIYGRSFZNRD-UHFFFAOYSA-O
MW166.25 g/mol
LogP-0.02
Rot. Bonds2

About methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)azanium

methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)azanium (PubChem CID 7236612) has the molecular formula C9H16N3+ and a molecular weight of 166.25 g/mol. Its IUPAC name is methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)azanium.

Molecular Properties

Compound Namemethyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)azanium
PubChem CID7236612
Molecular FormulaC9H16N3+
Molecular Weight166.25 g/mol
Exact Mass166.13
IUPAC Namemethyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)azanium
SMILESC[NH2+]Cc1n[nH]c2c1CCCC2
InChIInChI=1S/C9H15N3/c1-10-6-9-7-4-2-3-5-8(7)11-12-9/h10H,2-6H2,1H3,(H,11,12)/p+1
InChIKeyCPHCIYGRSFZNRD-UHFFFAOYSA-O
XLogP-0.02
TPSA45.29 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.25
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)azanium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanamine
CID 3157469
4,5,6,7-tetrahydro-1H-indazol-3-ylmethanamine
CID 3163200
3-(2,2-dimethylpropyl)-1,4,5,6,7,8-hexahydrocyclohepta[d]pyrazole
CID 59453579
3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanoate
CID 7236613
3-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-yl)propan-1-amine
CID 83845823
2-(4,5,6,7-tetrahydro-1H-indazol-3-yl)acetic acid
CID 21258059
2,2-dimethyl-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanoic acid
CID 83858861
N-(1,4,5,6,7,8-hexahydrocyclohepta[d]pyrazol-3-ylmethyl)cyclopropanamine
CID 62113034
(2S)-2-amino-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanoic acid
CID 102354753
(2S)-2-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)propane-1,2-diamine
CID 104867885
3-[(2-bromo-6-methylphenyl)methyl]-4,5,6,7-tetrahydro-1H-indazole
CID 101219134
3-methyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole
CID 59820661

Frequently Asked Questions

What is the IUPAC name of methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)azanium?
The IUPAC name of methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)azanium (CID 7236612) is methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)azanium.
What is the SMILES notation for methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)azanium?
The canonical SMILES for methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)azanium is C[NH2+]Cc1n[nH]c2c1CCCC2.
What is the InChIKey of methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)azanium?
The InChIKey is CPHCIYGRSFZNRD-UHFFFAOYSA-O. The full InChI is InChI=1S/C9H15N3/c1-10-6-9-7-4-2-3-5-8(7)11-12-9/h10H,2-6H2,1H3,(H,11,12)/p+1.
What are the key properties of methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)azanium?
methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)azanium has a molecular weight of 166.25 g/mol, XLogP of -0.02, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)azanium is sourced from PubChem (CID 7236612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).