3-ethyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine

C11H19N3 — CID 82586537

IUPAC3-ethyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
SMILESCCc1nn(C(C)C)c2c1CNCC2
InChIInChI=1S/C11H19N3/c1-4-10-9-7-12-6-5-11(9)14(13-10)8(2)3/h8,12H,4-7H2,1-3H3
InChIKeyKNTCGWLFQJVMMF-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.67
Rot. Bonds2

About 3-ethyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine

3-ethyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine (PubChem CID 82586537) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 3-ethyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name3-ethyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
PubChem CID82586537
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name3-ethyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
SMILESCCc1nn(C(C)C)c2c1CNCC2
InChIInChI=1S/C11H19N3/c1-4-10-9-7-12-6-5-11(9)14(13-10)8(2)3/h8,12H,4-7H2,1-3H3
InChIKeyKNTCGWLFQJVMMF-UHFFFAOYSA-N
XLogP1.67
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,3-diethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
CID 84647059
3-ethyl-1-propan-2-yl-6,7-dihydro-5H-indazol-4-one
CID 82590512
3-ethyl-1-[3-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
CID 82586621
1-(3-chlorophenyl)-3-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
CID 82586595
1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine-3-carbonitrile
CID 105444451
(2-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine
CID 112711119
1,1-dimethyl-3-[(1-propan-2-yl-5,6-dihydro-4H-pyrrolo[3,4-d]pyrazol-3-yl)methyl]urea
CID 154776355
N-[4-(1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)phenyl]acetamide
CID 82588326
(1-methyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanol;dihydrochloride
CID 50944322
ethyl 1-[(2R)-1,1,1-trifluoropropan-2-yl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylate
CID 177302574
3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
CID 105487454
(1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-yl)methanamine
CID 105449261

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The IUPAC name of 3-ethyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine (CID 82586537) is 3-ethyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine.
What is the SMILES notation for 3-ethyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The canonical SMILES for 3-ethyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine is CCc1nn(C(C)C)c2c1CNCC2.
What is the InChIKey of 3-ethyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The InChIKey is KNTCGWLFQJVMMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-4-10-9-7-12-6-5-11(9)14(13-10)8(2)3/h8,12H,4-7H2,1-3H3.
What are the key properties of 3-ethyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine?
3-ethyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine has a molecular weight of 193.29 g/mol, XLogP of 1.67, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine is sourced from PubChem (CID 82586537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).