4-(methoxymethyl)-N-(1-methylpyrazol-3-yl)piperidine-4-carboxamide;hydrochloride

C12H21ClN4O2 — CID 120618740

IUPAC4-(methoxymethyl)-N-(1-methylpyrazol-3-yl)piperidine-4-carboxamide;hydrochloride
SMILESCOCC1(C(=O)Nc2ccn(C)n2)CCNCC1.Cl
InChIInChI=1S/C12H20N4O2.ClH/c1-16-8-3-10(15-16)14-11(17)12(9-18-2)4-6-13-7-5-12;/h3,8,13H,4-7,9H2,1-2H3,(H,14,15,17);1H
InChIKeyBYHREVGKHJWTQO-UHFFFAOYSA-N
MW288.78 g/mol
LogP0.80
Rot. Bonds4

About 4-(methoxymethyl)-N-(1-methylpyrazol-3-yl)piperidine-4-carboxamide;hydrochloride

4-(methoxymethyl)-N-(1-methylpyrazol-3-yl)piperidine-4-carboxamide;hydrochloride (PubChem CID 120618740) has the molecular formula C12H21ClN4O2 and a molecular weight of 288.78 g/mol. Its IUPAC name is 4-(methoxymethyl)-N-(1-methylpyrazol-3-yl)piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name4-(methoxymethyl)-N-(1-methylpyrazol-3-yl)piperidine-4-carboxamide;hydrochloride
PubChem CID120618740
Molecular FormulaC12H21ClN4O2
Molecular Weight288.78 g/mol
Exact Mass288.14
IUPAC Name4-(methoxymethyl)-N-(1-methylpyrazol-3-yl)piperidine-4-carboxamide;hydrochloride
SMILESCOCC1(C(=O)Nc2ccn(C)n2)CCNCC1.Cl
InChIInChI=1S/C12H20N4O2.ClH/c1-16-8-3-10(15-16)14-11(17)12(9-18-2)4-6-13-7-5-12;/h3,8,13H,4-7,9H2,1-2H3,(H,14,15,17);1H
InChIKeyBYHREVGKHJWTQO-UHFFFAOYSA-N
XLogP0.80
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.78
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(methoxymethyl)-N-(4-pyrazol-1-ylphenyl)piperidine-4-carboxamide
CID 120619785
N-(1-methylpyrazol-3-yl)-2-piperidin-4-ylacetamide;hydrochloride
CID 119693548
N-[4-(dimethylcarbamoyl)phenyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120617739
N-methyl-4-[(1-methylpyrazol-3-yl)amino]piperidine-4-carboxamide
CID 155878996
4-(methoxymethyl)-N-[4-(triazol-2-yl)phenyl]piperidine-4-carboxamide
CID 120623718
2-(azetidin-3-yl)-N-(1-methylpyrazol-3-yl)acetamide
CID 64618955
N-(3,5-dimethoxyphenyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120616476
4-(methoxymethyl)-N-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-4-carboxamide
CID 120626064
N-(1-benzylimidazol-2-yl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120624254
N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120624559
N-ethyl-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120616337
N-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide
CID 120616741

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-N-(1-methylpyrazol-3-yl)piperidine-4-carboxamide;hydrochloride?
The IUPAC name of 4-(methoxymethyl)-N-(1-methylpyrazol-3-yl)piperidine-4-carboxamide;hydrochloride (CID 120618740) is 4-(methoxymethyl)-N-(1-methylpyrazol-3-yl)piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for 4-(methoxymethyl)-N-(1-methylpyrazol-3-yl)piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for 4-(methoxymethyl)-N-(1-methylpyrazol-3-yl)piperidine-4-carboxamide;hydrochloride is COCC1(C(=O)Nc2ccn(C)n2)CCNCC1.Cl.
What is the InChIKey of 4-(methoxymethyl)-N-(1-methylpyrazol-3-yl)piperidine-4-carboxamide;hydrochloride?
The InChIKey is BYHREVGKHJWTQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2.ClH/c1-16-8-3-10(15-16)14-11(17)12(9-18-2)4-6-13-7-5-12;/h3,8,13H,4-7,9H2,1-2H3,(H,14,15,17);1H.
What are the key properties of 4-(methoxymethyl)-N-(1-methylpyrazol-3-yl)piperidine-4-carboxamide;hydrochloride?
4-(methoxymethyl)-N-(1-methylpyrazol-3-yl)piperidine-4-carboxamide;hydrochloride has a molecular weight of 288.78 g/mol, XLogP of 0.80, 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-methylpyrazol-3-yl)piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 120618740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).