1-methyl-3-piperidin-3-ylindazol-7-amine

C13H18N4 — CID 175889087

IUPAC1-methyl-3-piperidin-3-ylindazol-7-amine
SMILESCn1nc(C2CCCNC2)c2cccc(N)c21
InChIInChI=1S/C13H18N4/c1-17-13-10(5-2-6-11(13)14)12(16-17)9-4-3-7-15-8-9/h2,5-6,9,15H,3-4,7-8,14H2,1H3
InChIKeyFIPVRGMVJCGUAH-UHFFFAOYSA-N
MW230.31 g/mol
LogP1.62
Rot. Bonds1

About 1-methyl-3-piperidin-3-ylindazol-7-amine

1-methyl-3-piperidin-3-ylindazol-7-amine (PubChem CID 175889087) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is 1-methyl-3-piperidin-3-ylindazol-7-amine.

Molecular Properties

Compound Name1-methyl-3-piperidin-3-ylindazol-7-amine
PubChem CID175889087
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name1-methyl-3-piperidin-3-ylindazol-7-amine
SMILESCn1nc(C2CCCNC2)c2cccc(N)c21
InChIInChI=1S/C13H18N4/c1-17-13-10(5-2-6-11(13)14)12(16-17)9-4-3-7-15-8-9/h2,5-6,9,15H,3-4,7-8,14H2,1H3
InChIKeyFIPVRGMVJCGUAH-UHFFFAOYSA-N
XLogP1.62
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-methoxy-3-piperidin-3-ylaniline
CID 174616983
1-pentyl-3-piperidin-3-ylindazole
CID 67818379
1-methyl-3-[(3R)-piperidin-3-yl]-5,6-dihydro-4H-cyclopenta[d]pyrazole
CID 129407936
7-fluoro-1,3-dimethyl-2-piperidin-3-ylindole
CID 84632385
1-piperidin-3-ylisoquinoline
CID 84782419
8-fluoro-4-piperidin-3-ylquinazoline
CID 105489373
3-[1-methyl-7-[[(3R)-piperidin-3-yl]methylamino]indazol-3-yl]piperidine-2,6-dione
CID 170629752
3-[4-bromo-1-methyl-5-(oxan-4-yl)pyrazol-3-yl]piperidine
CID 84608514
1-methyl-3-piperidin-3-yloxyindazole
CID 84694858
3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine
CID 83833173
methyl 8-amino-3-(azepan-3-yl)imidazo[1,5-a]pyridine-1-carboxylate
CID 117254701
N-[(2,5-dimethylpyrazol-3-yl)methyl]-3-[(3S)-piperidin-3-yl]benzamide
CID 99939569

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-piperidin-3-ylindazol-7-amine?
The IUPAC name of 1-methyl-3-piperidin-3-ylindazol-7-amine (CID 175889087) is 1-methyl-3-piperidin-3-ylindazol-7-amine.
What is the SMILES notation for 1-methyl-3-piperidin-3-ylindazol-7-amine?
The canonical SMILES for 1-methyl-3-piperidin-3-ylindazol-7-amine is Cn1nc(C2CCCNC2)c2cccc(N)c21.
What is the InChIKey of 1-methyl-3-piperidin-3-ylindazol-7-amine?
The InChIKey is FIPVRGMVJCGUAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-17-13-10(5-2-6-11(13)14)12(16-17)9-4-3-7-15-8-9/h2,5-6,9,15H,3-4,7-8,14H2,1H3.
What are the key properties of 1-methyl-3-piperidin-3-ylindazol-7-amine?
1-methyl-3-piperidin-3-ylindazol-7-amine has a molecular weight of 230.31 g/mol, XLogP of 1.62, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-piperidin-3-ylindazol-7-amine is sourced from PubChem (CID 175889087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).