5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-1H-indazole

C13H15N3 — CID 164753269

IUPAC5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-1H-indazole
SMILESCC1CC=C(c2ccc3[nH]ncc3c2)NC1
InChIInChI=1S/C13H15N3/c1-9-2-4-12(14-7-9)10-3-5-13-11(6-10)8-15-16-13/h3-6,8-9,14H,2,7H2,1H3,(H,15,16)
InChIKeyMZEMKFJDNYBKCV-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.53
Rot. Bonds1

About 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-1H-indazole

5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-1H-indazole (PubChem CID 164753269) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-1H-indazole.

Molecular Properties

Compound Name5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-1H-indazole
PubChem CID164753269
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC Name5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-1H-indazole
SMILESCC1CC=C(c2ccc3[nH]ncc3c2)NC1
InChIInChI=1S/C13H15N3/c1-9-2-4-12(14-7-9)10-3-5-13-11(6-10)8-15-16-13/h3-6,8-9,14H,2,7H2,1H3,(H,15,16)
InChIKeyMZEMKFJDNYBKCV-UHFFFAOYSA-N
XLogP2.53
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2-methyl-4-pyridinyl)-1H-indazole
CID 143158050
6-(2,3-dihydro-1-benzofuran-6-yl)-3-methyl-1,2,3,4-tetrahydropyridine
CID 171618608
azane;5-(4-propan-2-ylphenyl)-1H-indazole;dihydrochloride
CID 175178296
2-(1-methylpiperidin-4-yl)-7-[(3S)-3-methyl-1,2,3,4-tetrahydropyridin-6-yl]quinoline
CID 175802649
5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-2-(1,2,2,6,6-pentamethylpiperidin-4-yl)indazole
CID 164753147
5-(2-tert-butyl-4-pyridinyl)-1H-indazole
CID 58588587
5-(azetidin-3-yloxy)-1H-indazole
CID 84661998
3-(1H-indazol-5-yl)-1,2,4-thiadiazole
CID 67417996
ethane;5-methyl-1H-indazole
CID 178026047
4-(1H-indazol-5-yl)pyrimidin-2-amine
CID 54420708
5-(6-chloro-3-pyridinyl)-1H-indazole
CID 57355194
3-(1H-indazol-5-yl)-1,2,5-oxadiazole
CID 67417343

Frequently Asked Questions

What is the IUPAC name of 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-1H-indazole?
The IUPAC name of 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-1H-indazole (CID 164753269) is 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-1H-indazole.
What is the SMILES notation for 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-1H-indazole?
The canonical SMILES for 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-1H-indazole is CC1CC=C(c2ccc3[nH]ncc3c2)NC1.
What is the InChIKey of 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-1H-indazole?
The InChIKey is MZEMKFJDNYBKCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-9-2-4-12(14-7-9)10-3-5-13-11(6-10)8-15-16-13/h3-6,8-9,14H,2,7H2,1H3,(H,15,16).
What are the key properties of 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-1H-indazole?
5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-1H-indazole has a molecular weight of 213.28 g/mol, XLogP of 2.53, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-1H-indazole is sourced from PubChem (CID 164753269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).