N-(cyclohexylmethyl)-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride

C17H29ClN4O2 — CID 146051904

IUPACN-(cyclohexylmethyl)-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride
SMILESCOCCn1nc(C(=O)NCC2CCCCC2)c2c1CCNC2.Cl
InChIInChI=1S/C17H28N4O2.ClH/c1-23-10-9-21-15-7-8-18-12-14(15)16(20-21)17(22)19-11-13-5-3-2-4-6-13;/h13,18H,2-12H2,1H3,(H,19,22);1H
InChIKeySLKGTPLEMAINAP-UHFFFAOYSA-N
MW356.90 g/mol
LogP1.91
Rot. Bonds6

About N-(cyclohexylmethyl)-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride

N-(cyclohexylmethyl)-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride (PubChem CID 146051904) has the molecular formula C17H29ClN4O2 and a molecular weight of 356.90 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride
PubChem CID146051904
Molecular FormulaC17H29ClN4O2
Molecular Weight356.90 g/mol
Exact Mass356.20
IUPAC NameN-(cyclohexylmethyl)-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride
SMILESCOCCn1nc(C(=O)NCC2CCCCC2)c2c1CCNC2.Cl
InChIInChI=1S/C17H28N4O2.ClH/c1-23-10-9-21-15-7-8-18-12-14(15)16(20-21)17(22)19-11-13-5-3-2-4-6-13;/h13,18H,2-12H2,1H3,(H,19,22);1H
InChIKeySLKGTPLEMAINAP-UHFFFAOYSA-N
XLogP1.91
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.90
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(cyclohexylmethyl)-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride with MolForge

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Related Compounds

N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 124938633
[1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]-[4-(2-methylphenyl)piperazin-1-yl]methanone;hydrochloride
CID 146051903
N-(3-methoxypropyl)-1-methyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 82585465
methyl 1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylate
CID 105462928
5-cyclobutyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 45165107
N-ethyl-1-methyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 82585456
1-(cyclopropylmethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 176515483
N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(2-methoxyethyl)-5-(2-methylpropyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 45162773
1-[4-[1-(cyclopropylmethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carbonyl]piperazin-1-yl]ethanone;hydrochloride
CID 146051898
(5S)-1-(cyclohexylmethyl)-5-(2-methoxyethylamino)-N-methyl-4,5,6,7-tetrahydroindazole-3-carboxamide
CID 26228743
5-(5-acetylthiophene-2-carbonyl)-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-1-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 26143250
3-cycloheptyl-1-(cycloheptylmethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
CID 123485862

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride?
The IUPAC name of N-(cyclohexylmethyl)-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride (CID 146051904) is N-(cyclohexylmethyl)-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(cyclohexylmethyl)-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(cyclohexylmethyl)-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride is COCCn1nc(C(=O)NCC2CCCCC2)c2c1CCNC2.Cl.
What is the InChIKey of N-(cyclohexylmethyl)-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride?
The InChIKey is SLKGTPLEMAINAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O2.ClH/c1-23-10-9-21-15-7-8-18-12-14(15)16(20-21)17(22)19-11-13-5-3-2-4-6-13;/h13,18H,2-12H2,1H3,(H,19,22);1H.
What are the key properties of N-(cyclohexylmethyl)-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride?
N-(cyclohexylmethyl)-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride has a molecular weight of 356.90 g/mol, XLogP of 1.91, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-1-(2-methoxyethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride is sourced from PubChem (CID 146051904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).