3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride

C10H17ClN4O — CID 119944674

IUPAC3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride
SMILESCC1(C(=O)Nc2cn[nH]c2)CCCNC1.Cl
InChIInChI=1S/C10H16N4O.ClH/c1-10(3-2-4-11-7-10)9(15)14-8-5-12-13-6-8;/h5-6,11H,2-4,7H2,1H3,(H,12,13)(H,14,15);1H
InChIKeyHJRVJKPWFISNMQ-UHFFFAOYSA-N
MW244.73 g/mol
LogP1.16
Rot. Bonds2

About 3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride

3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride (PubChem CID 119944674) has the molecular formula C10H17ClN4O and a molecular weight of 244.73 g/mol. Its IUPAC name is 3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride
PubChem CID119944674
Molecular FormulaC10H17ClN4O
Molecular Weight244.73 g/mol
Exact Mass244.11
IUPAC Name3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride
SMILESCC1(C(=O)Nc2cn[nH]c2)CCCNC1.Cl
InChIInChI=1S/C10H16N4O.ClH/c1-10(3-2-4-11-7-10)9(15)14-8-5-12-13-6-8;/h5-6,11H,2-4,7H2,1H3,(H,12,13)(H,14,15);1H
InChIKeyHJRVJKPWFISNMQ-UHFFFAOYSA-N
XLogP1.16
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.73
LogP ≤ 51.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide
CID 130688568
3-methyl-N-pyridin-4-ylpiperidine-3-carboxamide;dihydrochloride
CID 119946059
N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119943521
3-fluoro-N-(1H-pyrazol-4-yl)pyrrolidine-3-carboxamide
CID 131020629
N-(4-methoxyphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119943571
3-propyl-N-(1H-pyrazol-4-yl)pyrrolidine-3-carboxamide
CID 63138545
3-methyl-N-(4-propan-2-yloxyphenyl)piperidine-3-carboxamide;hydrochloride
CID 119944238
3-methyl-N-thiophen-3-ylpiperidine-3-carboxamide
CID 66352634
3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide
CID 63131065
N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide
CID 113397758
3-methyl-N-[4-(triazol-2-yl)phenyl]piperidine-3-carboxamide
CID 63130247
N-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119943623

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride?
The IUPAC name of 3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride (CID 119944674) is 3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for 3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride?
The canonical SMILES for 3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride is CC1(C(=O)Nc2cn[nH]c2)CCCNC1.Cl.
What is the InChIKey of 3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride?
The InChIKey is HJRVJKPWFISNMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O.ClH/c1-10(3-2-4-11-7-10)9(15)14-8-5-12-13-6-8;/h5-6,11H,2-4,7H2,1H3,(H,12,13)(H,14,15);1H.
What are the key properties of 3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride?
3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride has a molecular weight of 244.73 g/mol, XLogP of 1.16, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119944674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).