3-(3,5-dimethylpyrazol-1-yl)-N-(4-hydroxycyclohexyl)propanamide

C14H23N3O2 — CID 43416849

IUPAC3-(3,5-dimethylpyrazol-1-yl)-N-(4-hydroxycyclohexyl)propanamide
SMILESCc1cc(C)n(CCC(=O)NC2CCC(O)CC2)n1
InChIInChI=1S/C14H23N3O2/c1-10-9-11(2)17(16-10)8-7-14(19)15-12-3-5-13(18)6-4-12/h9,12-13,18H,3-8H2,1-2H3,(H,15,19)
InChIKeyYIGDTNCDEPLFCY-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.31
Rot. Bonds4

About 3-(3,5-dimethylpyrazol-1-yl)-N-(4-hydroxycyclohexyl)propanamide

3-(3,5-dimethylpyrazol-1-yl)-N-(4-hydroxycyclohexyl)propanamide (PubChem CID 43416849) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 3-(3,5-dimethylpyrazol-1-yl)-N-(4-hydroxycyclohexyl)propanamide.

Molecular Properties

Compound Name3-(3,5-dimethylpyrazol-1-yl)-N-(4-hydroxycyclohexyl)propanamide
PubChem CID43416849
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name3-(3,5-dimethylpyrazol-1-yl)-N-(4-hydroxycyclohexyl)propanamide
SMILESCc1cc(C)n(CCC(=O)NC2CCC(O)CC2)n1
InChIInChI=1S/C14H23N3O2/c1-10-9-11(2)17(16-10)8-7-14(19)15-12-3-5-13(18)6-4-12/h9,12-13,18H,3-8H2,1-2H3,(H,15,19)
InChIKeyYIGDTNCDEPLFCY-UHFFFAOYSA-N
XLogP1.31
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3,5-dimethylpyrazol-1-yl)-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)propanamide
CID 19557611
3-(3,5-dimethylpyrazol-1-yl)-N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)propanamide
CID 86772651
2-cyclopropyl-2-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]acetic acid
CID 62697672
N-[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-3-(3,5-dimethylpyrazol-1-yl)propanamide
CID 45191724
N-cyclopropyl-2-[4-[(3,5-dimethylpyrazol-1-yl)methyl]piperidin-1-yl]acetamide
CID 90495505
N-(4-hydroxycyclohexyl)-2,5-dimethylpyrazole-3-carboxamide
CID 61057507
N-[(3S,7S,8aS)-3-[2-(dimethylamino)-2-oxoethyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-7-yl]-3-(3,5-dimethylpyrazol-1-yl)propanamide
CID 155504452
N-(azetidin-3-yl)-2-(3,5-dimethylpyrazol-1-yl)acetamide
CID 66185586
3-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]-3-methylbutanoic acid
CID 64670513
1-cyclobutyl-3-[3-(3,5-dimethylpyrazol-1-yl)propyl]urea
CID 113233160
N-[(S)-cyclopropyl(phenyl)methyl]-3-(3,5-dimethylpyrazol-1-yl)propanamide
CID 31407290
3-(3,5-dimethylpyrazol-1-yl)-N-(2-hydroxypropyl)propanamide
CID 43418241

Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dimethylpyrazol-1-yl)-N-(4-hydroxycyclohexyl)propanamide?
The IUPAC name of 3-(3,5-dimethylpyrazol-1-yl)-N-(4-hydroxycyclohexyl)propanamide (CID 43416849) is 3-(3,5-dimethylpyrazol-1-yl)-N-(4-hydroxycyclohexyl)propanamide.
What is the SMILES notation for 3-(3,5-dimethylpyrazol-1-yl)-N-(4-hydroxycyclohexyl)propanamide?
The canonical SMILES for 3-(3,5-dimethylpyrazol-1-yl)-N-(4-hydroxycyclohexyl)propanamide is Cc1cc(C)n(CCC(=O)NC2CCC(O)CC2)n1.
What is the InChIKey of 3-(3,5-dimethylpyrazol-1-yl)-N-(4-hydroxycyclohexyl)propanamide?
The InChIKey is YIGDTNCDEPLFCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-10-9-11(2)17(16-10)8-7-14(19)15-12-3-5-13(18)6-4-12/h9,12-13,18H,3-8H2,1-2H3,(H,15,19).
What are the key properties of 3-(3,5-dimethylpyrazol-1-yl)-N-(4-hydroxycyclohexyl)propanamide?
3-(3,5-dimethylpyrazol-1-yl)-N-(4-hydroxycyclohexyl)propanamide has a molecular weight of 265.36 g/mol, XLogP of 1.31, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dimethylpyrazol-1-yl)-N-(4-hydroxycyclohexyl)propanamide is sourced from PubChem (CID 43416849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).