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

C13H22N4O — CID 104618838

IUPACN-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-4-carboxamide
SMILESCCC1(C(=O)Nc2n[nH]c(C)c2C)CCNCC1
InChIInChI=1S/C13H22N4O/c1-4-13(5-7-14-8-6-13)12(18)15-11-9(2)10(3)16-17-11/h14H,4-8H2,1-3H3,(H2,15,16,17,18)
InChIKeyXDSBOZPNFLLDLP-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.74
Rot. Bonds3

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

N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-4-carboxamide (PubChem CID 104618838) 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-4-carboxamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-4-carboxamide
PubChem CID104618838
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-4-carboxamide
SMILESCCC1(C(=O)Nc2n[nH]c(C)c2C)CCNCC1
InChIInChI=1S/C13H22N4O/c1-4-13(5-7-14-8-6-13)12(18)15-11-9(2)10(3)16-17-11/h14H,4-8H2,1-3H3,(H2,15,16,17,18)
InChIKeyXDSBOZPNFLLDLP-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

N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-ethylpyrrolidine-3-carboxamide
CID 113433636
N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-propylpyrrolidine-3-carboxamide
CID 113433645
N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methylpiperidine-3-carboxamide
CID 104618888
4-ethyl-N-pyridin-4-ylpiperidine-4-carboxamide
CID 63127778
1-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide
CID 114829916
4-ethyl-N-(4-ethylphenyl)piperidine-4-carboxamide
CID 63127797
2-chloro-N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide
CID 104617747
2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide
CID 104618733
4-ethyl-N-methoxypiperidine-4-carboxamide
CID 64974919
(3S)-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide
CID 104618674
4-ethyl-N-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide
CID 63127198
N-(3-carbamoyl-2-methylphenyl)-4-ethylpiperidine-4-carboxamide
CID 63127964

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-4-carboxamide?
The IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-4-carboxamide (CID 104618838) is N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-4-carboxamide.
What is the SMILES notation for N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-4-carboxamide?
The canonical SMILES for N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-4-carboxamide is CCC1(C(=O)Nc2n[nH]c(C)c2C)CCNCC1.
What is the InChIKey of N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-4-carboxamide?
The InChIKey is XDSBOZPNFLLDLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-4-13(5-7-14-8-6-13)12(18)15-11-9(2)10(3)16-17-11/h14H,4-8H2,1-3H3,(H2,15,16,17,18).
What are the key properties of N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-4-carboxamide?
N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-ethylpiperidine-4-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-4-carboxamide is sourced from PubChem (CID 104618838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).