2-cyclohexyl-N-[1-[(3S)-oxolan-3-yl]pyrazol-4-yl]acetamide

C15H23N3O2 — CID 97428018

IUPAC2-cyclohexyl-N-[1-[(3S)-oxolan-3-yl]pyrazol-4-yl]acetamide
SMILESO=C(CC1CCCCC1)Nc1cnn([C@H]2CCOC2)c1
InChIInChI=1S/C15H23N3O2/c19-15(8-12-4-2-1-3-5-12)17-13-9-16-18(10-13)14-6-7-20-11-14/h9-10,12,14H,1-8,11H2,(H,17,19)/t14-/m0/s1
InChIKeyWUFIRPVTWWVJMM-AWEZNQCLSA-N
MW277.37 g/mol
LogP2.75
Rot. Bonds4

About 2-cyclohexyl-N-[1-[(3S)-oxolan-3-yl]pyrazol-4-yl]acetamide

2-cyclohexyl-N-[1-[(3S)-oxolan-3-yl]pyrazol-4-yl]acetamide (PubChem CID 97428018) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-cyclohexyl-N-[1-[(3S)-oxolan-3-yl]pyrazol-4-yl]acetamide.

Molecular Properties

Compound Name2-cyclohexyl-N-[1-[(3S)-oxolan-3-yl]pyrazol-4-yl]acetamide
PubChem CID97428018
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name2-cyclohexyl-N-[1-[(3S)-oxolan-3-yl]pyrazol-4-yl]acetamide
SMILESO=C(CC1CCCCC1)Nc1cnn([C@H]2CCOC2)c1
InChIInChI=1S/C15H23N3O2/c19-15(8-12-4-2-1-3-5-12)17-13-9-16-18(10-13)14-6-7-20-11-14/h9-10,12,14H,1-8,11H2,(H,17,19)/t14-/m0/s1
InChIKeyWUFIRPVTWWVJMM-AWEZNQCLSA-N
XLogP2.75
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-(tetrahydrofuran-3-yl)-1H-pyrazol-4-yl)bicyclo[2.2.1]hept-5-ene-2-carboxamide
CID 72719630
1-acetamido-N-(1-ethylpyrazol-4-yl)cyclohexane-1-carboxamide
CID 75416559
2-methyl-N-[1-[(3S)-oxolan-3-yl]pyrazol-4-yl]propanamide
CID 97428010
4-ethyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]cyclohexane-1-carboxamide
CID 99825420
N-[1-(2-methoxyethyl)pyrazol-4-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide
CID 132319246
potassium 2-amino-2-(4,4-difluorocyclohexyl)-N-[3-fluoro-1-[1-methoxy-3-(2,2,2-trifluoroethylamino)but-3-en-2-yl]pyrazol-4-yl]acetamide
CID 169172618
(2S)-2-amino-2-(4,4-difluorocyclohexyl)-N-[3-fluoro-1-[2-methoxy-1-[3-(2,2,2-trifluoroethyl)-1,2-dihydrotriazol-4-yl]ethyl]pyrazol-4-yl]acetamide
CID 169172821
(2S)-2-amino-3-(4-fluorocyclohexyl)-N-(1-methylpyrazol-4-yl)propanamide
CID 177043302
N-[1-(2,2,2-trifluoroethoxymethyl)pyrazol-4-yl]cyclohexanecarboxamide
CID 19340856
3-cyclopentyl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]propanamide
CID 75358380
N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]cyclohexanecarboxamide
CID 75358382
Methyl 2-[4-[(4,4-difluorocyclohexanecarbonyl)amino]pyrazol-1-yl]acetate
CID 81929132

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-[1-[(3S)-oxolan-3-yl]pyrazol-4-yl]acetamide?
The IUPAC name of 2-cyclohexyl-N-[1-[(3S)-oxolan-3-yl]pyrazol-4-yl]acetamide (CID 97428018) is 2-cyclohexyl-N-[1-[(3S)-oxolan-3-yl]pyrazol-4-yl]acetamide.
What is the SMILES notation for 2-cyclohexyl-N-[1-[(3S)-oxolan-3-yl]pyrazol-4-yl]acetamide?
The canonical SMILES for 2-cyclohexyl-N-[1-[(3S)-oxolan-3-yl]pyrazol-4-yl]acetamide is O=C(CC1CCCCC1)Nc1cnn([C@H]2CCOC2)c1.
What is the InChIKey of 2-cyclohexyl-N-[1-[(3S)-oxolan-3-yl]pyrazol-4-yl]acetamide?
The InChIKey is WUFIRPVTWWVJMM-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H23N3O2/c19-15(8-12-4-2-1-3-5-12)17-13-9-16-18(10-13)14-6-7-20-11-14/h9-10,12,14H,1-8,11H2,(H,17,19)/t14-/m0/s1.
What are the key properties of 2-cyclohexyl-N-[1-[(3S)-oxolan-3-yl]pyrazol-4-yl]acetamide?
2-cyclohexyl-N-[1-[(3S)-oxolan-3-yl]pyrazol-4-yl]acetamide has a molecular weight of 277.37 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-[1-[(3S)-oxolan-3-yl]pyrazol-4-yl]acetamide is sourced from PubChem (CID 97428018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).