1-methyl-6-pyrrolidin-1-ylindazole

C12H15N3 — CID 123532355

IUPAC1-methyl-6-pyrrolidin-1-ylindazole
SMILESCn1ncc2ccc(N3CCCC3)cc21
InChIInChI=1S/C12H15N3/c1-14-12-8-11(15-6-2-3-7-15)5-4-10(12)9-13-14/h4-5,8-9H,2-3,6-7H2,1H3
InChIKeyBGYZFTYNGNVCLS-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.17
Rot. Bonds1

About 1-methyl-6-pyrrolidin-1-ylindazole

1-methyl-6-pyrrolidin-1-ylindazole (PubChem CID 123532355) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 1-methyl-6-pyrrolidin-1-ylindazole.

Molecular Properties

Compound Name1-methyl-6-pyrrolidin-1-ylindazole
PubChem CID123532355
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name1-methyl-6-pyrrolidin-1-ylindazole
SMILESCn1ncc2ccc(N3CCCC3)cc21
InChIInChI=1S/C12H15N3/c1-14-12-8-11(15-6-2-3-7-15)5-4-10(12)9-13-14/h4-5,8-9H,2-3,6-7H2,1H3
InChIKeyBGYZFTYNGNVCLS-UHFFFAOYSA-N
XLogP2.17
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-1-(1-methylindazol-6-yl)pyrrolidine-3-carboxamide
CID 118058043
tert-butyl 4-(1-methylindazol-6-yl)piperazine-1-carboxylate;ethane
CID 142622902
N,1-dimethylindazol-6-amine
CID 23544368
1-methylindazole-6-sulfonic acid
CID 22889763
4-(aminomethyl)-1-(1-methylindazol-6-yl)pyrrolidin-2-one
CID 168660102
ethane;(1-methylindazol-6-yl)methanol
CID 168921165
1-(10-pyrrolidin-1-ylpicen-3-yl)pyrrolidine
CID 58426575
4-(2-methoxy-5-pyrrolidin-1-ylphenyl)-1-methylpyrazol-5-amine
CID 117433956
1-methylindazole-6-sulfonyl fluoride
CID 156875828
6-butan-2-yl-1-methylindazole
CID 118069514
2-methyl-6-piperidin-1-ylquinoline
CID 82242491
2-(1-methylindazol-6-yl)acetonitrile
CID 84765976

Frequently Asked Questions

What is the IUPAC name of 1-methyl-6-pyrrolidin-1-ylindazole?
The IUPAC name of 1-methyl-6-pyrrolidin-1-ylindazole (CID 123532355) is 1-methyl-6-pyrrolidin-1-ylindazole.
What is the SMILES notation for 1-methyl-6-pyrrolidin-1-ylindazole?
The canonical SMILES for 1-methyl-6-pyrrolidin-1-ylindazole is Cn1ncc2ccc(N3CCCC3)cc21.
What is the InChIKey of 1-methyl-6-pyrrolidin-1-ylindazole?
The InChIKey is BGYZFTYNGNVCLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-14-12-8-11(15-6-2-3-7-15)5-4-10(12)9-13-14/h4-5,8-9H,2-3,6-7H2,1H3.
What are the key properties of 1-methyl-6-pyrrolidin-1-ylindazole?
1-methyl-6-pyrrolidin-1-ylindazole has a molecular weight of 201.27 g/mol, XLogP of 2.17, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6-pyrrolidin-1-ylindazole is sourced from PubChem (CID 123532355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).