N-methyl-4-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidine-2-carboxamide

C14H24N4O — CID 106779584

IUPACN-methyl-4-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidine-2-carboxamide
SMILESCNC(=O)C1CC(Cc2ccn(C(C)C)n2)CCN1
InChIInChI=1S/C14H24N4O/c1-10(2)18-7-5-12(17-18)8-11-4-6-16-13(9-11)14(19)15-3/h5,7,10-11,13,16H,4,6,8-9H2,1-3H3,(H,15,19)
InChIKeyJTHRJDYZMZZWAT-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.12
Rot. Bonds4

About N-methyl-4-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidine-2-carboxamide

N-methyl-4-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidine-2-carboxamide (PubChem CID 106779584) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-methyl-4-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-4-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidine-2-carboxamide
PubChem CID106779584
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-methyl-4-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidine-2-carboxamide
SMILESCNC(=O)C1CC(Cc2ccn(C(C)C)n2)CCN1
InChIInChI=1S/C14H24N4O/c1-10(2)18-7-5-12(17-18)8-11-4-6-16-13(9-11)14(19)15-3/h5,7,10-11,13,16H,4,6,8-9H2,1-3H3,(H,15,19)
InChIKeyJTHRJDYZMZZWAT-UHFFFAOYSA-N
XLogP1.12
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-4-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxamide
CID 106780087
4-[(4-tert-butylphenyl)methyl]-N-methylpiperidine-2-carboxamide
CID 106778581
3-[(3-chlorocyclohexyl)methyl]-1-propan-2-ylpyrazole
CID 64801732
N-ethyl-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclohexan-1-amine
CID 64801340
3-[(1-propan-2-ylpyrazol-3-yl)methyl]-N-propylcycloheptan-1-amine
CID 64801922
4-ethyl-2-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclohexane-1-carboxylic acid
CID 81020642
4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide
CID 106781123
1-(3-aminocyclohexyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanone
CID 116568846
4-(1-ethylimidazol-2-yl)-N-methylpiperidine-2-carboxamide
CID 106779170
1-(azepan-2-yl)-2-(1-butan-2-ylpyrazol-3-yl)ethanone
CID 116582497
2-[(1-propan-2-ylpyrazol-3-yl)methyl]cycloheptan-1-ol
CID 64772657
1-cyclopropyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-one
CID 64773472

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidine-2-carboxamide?
The IUPAC name of N-methyl-4-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidine-2-carboxamide (CID 106779584) is N-methyl-4-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidine-2-carboxamide.
What is the SMILES notation for N-methyl-4-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidine-2-carboxamide?
The canonical SMILES for N-methyl-4-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidine-2-carboxamide is CNC(=O)C1CC(Cc2ccn(C(C)C)n2)CCN1.
What is the InChIKey of N-methyl-4-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidine-2-carboxamide?
The InChIKey is JTHRJDYZMZZWAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-10(2)18-7-5-12(17-18)8-11-4-6-16-13(9-11)14(19)15-3/h5,7,10-11,13,16H,4,6,8-9H2,1-3H3,(H,15,19).
What are the key properties of N-methyl-4-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidine-2-carboxamide?
N-methyl-4-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidine-2-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 1.12, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidine-2-carboxamide is sourced from PubChem (CID 106779584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).