4-[2-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)ethyl]morpholine

C14H23N3O — CID 11624240

IUPAC4-[2-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)ethyl]morpholine
SMILESCn1ncc2c1CCCC2CCN1CCOCC1
InChIInChI=1S/C14H23N3O/c1-16-14-4-2-3-12(13(14)11-15-16)5-6-17-7-9-18-10-8-17/h11-12H,2-10H2,1H3
InChIKeyRYOMPQZSKYAHDY-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.56
Rot. Bonds3

About 4-[2-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)ethyl]morpholine

4-[2-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)ethyl]morpholine (PubChem CID 11624240) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 4-[2-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)ethyl]morpholine
PubChem CID11624240
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name4-[2-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)ethyl]morpholine
SMILESCn1ncc2c1CCCC2CCN1CCOCC1
InChIInChI=1S/C14H23N3O/c1-16-14-4-2-3-12(13(14)11-15-16)5-6-17-7-9-18-10-8-17/h11-12H,2-10H2,1H3
InChIKeyRYOMPQZSKYAHDY-UHFFFAOYSA-N
XLogP1.56
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methoxyethyl)-4,5,6,7-tetrahydro-1H-indazol-7-amine
CID 75480822
1-Morpholin-4-yl-2-(4,5,6,7-tetrahydroindazol-2-yl)ethanone
CID 5309073
5-(2-ethoxyethyl)-7-(ethoxymethyl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine
CID 118746678
N-[(7S)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]morpholine-4-sulfonamide
CID 97346802
2-[methyl-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]amino]ethyl N,N-dimethylcarbamate
CID 97878979
N-(cyclopropylmethyl)-2-methyl-N-[(4-methylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroindazole-4-carboxamide
CID 121542996
4-Methyl-1-(2,2,2-trifluoroethyl)-4,5,6,7-tetrahydroindazole
CID 144170530
4-Fluoro-3-(3-methylbutan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 167303848
1-Ethyl-4-[4-fluoro-1-(2-methoxyethyl)pyrazol-5-yl]piperidine
CID 176691876
4-[4-Fluoro-1-(2-methoxyethyl)pyrazol-5-yl]-1-propan-2-ylpiperidine
CID 176693083
1-methyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]-4,5,6,7-tetrahydroindazol-4-amine
CID 63826420
N-[2-(2,2-difluoroethoxy)ethyl]-1-methyl-4,5,6,7-tetrahydroindazol-4-amine
CID 113773151

Frequently Asked Questions

What is the IUPAC name of 4-[2-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)ethyl]morpholine?
The IUPAC name of 4-[2-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)ethyl]morpholine (CID 11624240) is 4-[2-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)ethyl]morpholine.
What is the SMILES notation for 4-[2-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)ethyl]morpholine?
The canonical SMILES for 4-[2-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)ethyl]morpholine is Cn1ncc2c1CCCC2CCN1CCOCC1.
What is the InChIKey of 4-[2-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)ethyl]morpholine?
The InChIKey is RYOMPQZSKYAHDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-16-14-4-2-3-12(13(14)11-15-16)5-6-17-7-9-18-10-8-17/h11-12H,2-10H2,1H3.
What are the key properties of 4-[2-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)ethyl]morpholine?
4-[2-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)ethyl]morpholine has a molecular weight of 249.36 g/mol, XLogP of 1.56, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)ethyl]morpholine is sourced from PubChem (CID 11624240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).