N-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride

C15H25ClN4O — CID 56832000

IUPACN-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride
SMILESCCN(C(=O)c1n[nH]c2c1CNCC2)C1CCCCC1.Cl
InChIInChI=1S/C15H24N4O.ClH/c1-2-19(11-6-4-3-5-7-11)15(20)14-12-10-16-9-8-13(12)17-18-14;/h11,16H,2-10H2,1H3,(H,17,18);1H
InChIKeyQLOJGZLYLHMNGO-UHFFFAOYSA-N
MW312.85 g/mol
LogP2.27
Rot. Bonds3

About N-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride

N-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride (PubChem CID 56832000) has the molecular formula C15H25ClN4O and a molecular weight of 312.85 g/mol. Its IUPAC name is N-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride
PubChem CID56832000
Molecular FormulaC15H25ClN4O
Molecular Weight312.85 g/mol
Exact Mass312.17
IUPAC NameN-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride
SMILESCCN(C(=O)c1n[nH]c2c1CNCC2)C1CCCCC1.Cl
InChIInChI=1S/C15H24N4O.ClH/c1-2-19(11-6-4-3-5-7-11)15(20)14-12-10-16-9-8-13(12)17-18-14;/h11,16H,2-10H2,1H3,(H,17,18);1H
InChIKeyQLOJGZLYLHMNGO-UHFFFAOYSA-N
XLogP2.27
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.85
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride?
The IUPAC name of N-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride (CID 56832000) is N-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride?
The canonical SMILES for N-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride is CCN(C(=O)c1n[nH]c2c1CNCC2)C1CCCCC1.Cl.
What is the InChIKey of N-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride?
The InChIKey is QLOJGZLYLHMNGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O.ClH/c1-2-19(11-6-4-3-5-7-11)15(20)14-12-10-16-9-8-13(12)17-18-14;/h11,16H,2-10H2,1H3,(H,17,18);1H.
What are the key properties of N-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride?
N-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride has a molecular weight of 312.85 g/mol, XLogP of 2.27, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride is sourced from PubChem (CID 56832000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).