N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-2-carboxamide

C13H22N4O — CID 114429513

IUPACN-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)Nc2n[nH]c(C)c2C)C1
InChIInChI=1S/C13H22N4O/c1-4-10-5-6-14-11(7-10)13(18)15-12-8(2)9(3)16-17-12/h10-11,14H,4-7H2,1-3H3,(H2,15,16,17,18)
InChIKeyFKJPSNGHSGUOBW-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.74
Rot. Bonds3

About N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-2-carboxamide

N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-2-carboxamide (PubChem CID 114429513) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-2-carboxamide
PubChem CID114429513
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)Nc2n[nH]c(C)c2C)C1
InChIInChI=1S/C13H22N4O/c1-4-10-5-6-14-11(7-10)13(18)15-12-8(2)9(3)16-17-12/h10-11,14H,4-7H2,1-3H3,(H2,15,16,17,18)
InChIKeyFKJPSNGHSGUOBW-UHFFFAOYSA-N
XLogP1.74
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-2-carboxamide
CID 104914702
N-(2,3-dimethylphenyl)-4-ethylpiperidine-2-carboxamide
CID 114427932
4-ethyl-N-(3-fluoro-2-methylphenyl)piperidine-2-carboxamide
CID 114428836
4-ethyl-N-(1,2-oxazol-3-yl)piperidine-2-carboxamide
CID 114428961
4-ethyl-N-(2,4,6-trichlorophenyl)piperidine-2-carboxamide
CID 114428009
N-(2,6-difluorophenyl)-4-ethylpiperidine-2-carboxamide
CID 114428002
N-(1,3-benzothiazol-2-yl)-4-ethylpiperidine-2-carboxamide
CID 114427950
N-(4-acetyl-1,3-thiazol-2-yl)-4-ethylpiperidine-2-carboxamide
CID 114429119
4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide
CID 114428947
N-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide
CID 114427824
N-(2-chloro-6-methylphenyl)-4-ethylpiperidine-2-carboxamide
CID 114429222
4-ethyl-N-(5-fluoro-2-pyridinyl)piperidine-2-carboxamide
CID 114429180

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-2-carboxamide?
The IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-2-carboxamide (CID 114429513) is N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-2-carboxamide.
What is the SMILES notation for N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-2-carboxamide?
The canonical SMILES for N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-2-carboxamide is CCC1CCNC(C(=O)Nc2n[nH]c(C)c2C)C1.
What is the InChIKey of N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-2-carboxamide?
The InChIKey is FKJPSNGHSGUOBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-4-10-5-6-14-11(7-10)13(18)15-12-8(2)9(3)16-17-12/h10-11,14H,4-7H2,1-3H3,(H2,15,16,17,18).
What are the key properties of N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-2-carboxamide?
N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-2-carboxamide has a molecular weight of 250.35 g/mol, XLogP of 1.74, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-2-carboxamide is sourced from PubChem (CID 114429513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).