N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-methylpiperidine-4-carboxamide

C14H24N4O — CID 112669209

IUPACN-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-methylpiperidine-4-carboxamide
SMILESCCc1nn(C)cc1CNC(=O)C1(C)CCNCC1
InChIInChI=1S/C14H24N4O/c1-4-12-11(10-18(3)17-12)9-16-13(19)14(2)5-7-15-8-6-14/h10,15H,4-9H2,1-3H3,(H,16,19)
InChIKeyYWWPATMUFJDWEP-UHFFFAOYSA-N
MW264.37 g/mol
LogP0.99
Rot. Bonds4

About N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-methylpiperidine-4-carboxamide

N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-methylpiperidine-4-carboxamide (PubChem CID 112669209) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-methylpiperidine-4-carboxamide
PubChem CID112669209
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-methylpiperidine-4-carboxamide
SMILESCCc1nn(C)cc1CNC(=O)C1(C)CCNCC1
InChIInChI=1S/C14H24N4O/c1-4-12-11(10-18(3)17-12)9-16-13(19)14(2)5-7-15-8-6-14/h10,15H,4-9H2,1-3H3,(H,16,19)
InChIKeyYWWPATMUFJDWEP-UHFFFAOYSA-N
XLogP0.99
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 ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(aminomethyl)-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]cyclopropane-1-carboxamide
CID 112668695
N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-3-piperidin-4-ylpropanamide
CID 115989866
2-bromo-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]butanamide
CID 112668671
3-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-1,1-dimethylurea
CID 115887051
2-(1-aminocyclobutyl)-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]acetamide
CID 112669267
1-cyclopentyl-3-[(3-ethyl-1-methylpyrazol-4-yl)methyl]urea
CID 115887050
1-[2-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]-2-oxoethyl]cyclopentane-1-carboxylic acid
CID 115886750
N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-2-hydroxy-2-methylpropanamide
CID 103430361
1-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-3-(2-methylprop-2-enyl)urea
CID 91661490
3-[(3-ethyl-1-methylpyrazol-4-yl)methylcarbamoyl]-2,2-dimethylcyclopropane-1-carboxylic acid
CID 115989215
5-[(3-ethyl-1-methylpyrazol-4-yl)methylcarbamoyl]thiophene-2-carboxylic acid
CID 115991451
N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-2-(methylamino)acetamide;hydrochloride
CID 120705685

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-methylpiperidine-4-carboxamide?
The IUPAC name of N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-methylpiperidine-4-carboxamide (CID 112669209) is N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-methylpiperidine-4-carboxamide?
The canonical SMILES for N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-methylpiperidine-4-carboxamide is CCc1nn(C)cc1CNC(=O)C1(C)CCNCC1.
What is the InChIKey of N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-methylpiperidine-4-carboxamide?
The InChIKey is YWWPATMUFJDWEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-4-12-11(10-18(3)17-12)9-16-13(19)14(2)5-7-15-8-6-14/h10,15H,4-9H2,1-3H3,(H,16,19).
What are the key properties of N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-methylpiperidine-4-carboxamide?
N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-methylpiperidine-4-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 0.99, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-methylpiperidine-4-carboxamide is sourced from PubChem (CID 112669209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).