4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride

C16H27ClN4O2 — CID 120623245

IUPAC4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride
SMILESCOCC1(C(=O)NC2CCCc3c2cnn3C)CCNCC1.Cl
InChIInChI=1S/C16H26N4O2.ClH/c1-20-14-5-3-4-13(12(14)10-18-20)19-15(21)16(11-22-2)6-8-17-9-7-16;/h10,13,17H,3-9,11H2,1-2H3,(H,19,21);1H
InChIKeyJFCFYEASVXNNBB-UHFFFAOYSA-N
MW342.87 g/mol
LogP1.35
Rot. Bonds4

About 4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride

4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride (PubChem CID 120623245) has the molecular formula C16H27ClN4O2 and a molecular weight of 342.87 g/mol. Its IUPAC name is 4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride
PubChem CID120623245
Molecular FormulaC16H27ClN4O2
Molecular Weight342.87 g/mol
Exact Mass342.18
IUPAC Name4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride
SMILESCOCC1(C(=O)NC2CCCc3c2cnn3C)CCNCC1.Cl
InChIInChI=1S/C16H26N4O2.ClH/c1-20-14-5-3-4-13(12(14)10-18-20)19-15(21)16(11-22-2)6-8-17-9-7-16;/h10,13,17H,3-9,11H2,1-2H3,(H,19,21);1H
InChIKeyJFCFYEASVXNNBB-UHFFFAOYSA-N
XLogP1.35
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.87
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride
CID 119730419
4-(aminomethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)oxane-4-carboxamide;hydrochloride
CID 120925257
1-amino-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)cyclopropane-1-carboxamide
CID 65464227
1-amino-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)cyclohexane-1-carboxamide;hydrochloride
CID 119293137
N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119730423
2-methoxy-2-methyl-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)propanamide
CID 113233382
N-(2,3-dihydro-1H-inden-1-yl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120619174
2-(3,4-dimethoxyphenyl)-N-[(4R)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]acetamide
CID 94080097
2-cyclopentyloxy-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide
CID 71939980
N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)cyclopropanecarboxamide
CID 42958313
3-amino-3-methyl-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)butanamide
CID 64683649
2-cyano-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide
CID 110470107

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride?
The IUPAC name of 4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride (CID 120623245) is 4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for 4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for 4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride is COCC1(C(=O)NC2CCCc3c2cnn3C)CCNCC1.Cl.
What is the InChIKey of 4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride?
The InChIKey is JFCFYEASVXNNBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O2.ClH/c1-20-14-5-3-4-13(12(14)10-18-20)19-15(21)16(11-22-2)6-8-17-9-7-16;/h10,13,17H,3-9,11H2,1-2H3,(H,19,21);1H.
What are the key properties of 4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride?
4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride has a molecular weight of 342.87 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 120623245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).