N-[(3R)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide

C18H27N3O3 — CID 124738558

IUPACN-[(3R)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide
SMILESCC(C)c1cc(C(=O)N[C@@H]2CCCN(C3CCCCC3)C2=O)no1
InChIInChI=1S/C18H27N3O3/c1-12(2)16-11-15(20-24-16)17(22)19-14-9-6-10-21(18(14)23)13-7-4-3-5-8-13/h11-14H,3-10H2,1-2H3,(H,19,22)/t14-/m1/s1
InChIKeyRAIWQEYUMFAQFI-CQSZACIVSA-N
MW333.43 g/mol
LogP2.85
Rot. Bonds4

About N-[(3R)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide

N-[(3R)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide (PubChem CID 124738558) has the molecular formula C18H27N3O3 and a molecular weight of 333.43 g/mol. Its IUPAC name is N-[(3R)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-[(3R)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide
PubChem CID124738558
Molecular FormulaC18H27N3O3
Molecular Weight333.43 g/mol
Exact Mass333.21
IUPAC NameN-[(3R)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide
SMILESCC(C)c1cc(C(=O)N[C@@H]2CCCN(C3CCCCC3)C2=O)no1
InChIInChI=1S/C18H27N3O3/c1-12(2)16-11-15(20-24-16)17(22)19-14-9-6-10-21(18(14)23)13-7-4-3-5-8-13/h11-14H,3-10H2,1-2H3,(H,19,22)/t14-/m1/s1
InChIKeyRAIWQEYUMFAQFI-CQSZACIVSA-N
XLogP2.85
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(3R)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide with MolForge

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Related Compounds

N-[(3S)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-cyclopropyl-1,2-oxazole-3-carboxamide
CID 124738321
N-[(1R,2S)-2-cyclohexylcyclopropyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 124591295
1-cyclopentyl-4-(5-propan-2-yl-1,2-oxazole-3-carbonyl)piperazin-2-one
CID 70782658
5-bromo-N-(1-cyclohexyl-2-oxopyrrolidin-3-yl)-1H-pyrazole-3-carboxamide
CID 146107608
N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 56731507
N-[4-(4-methylpiperidin-1-yl)cyclohexyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 119043051
N-[(3R,5S)-5-(3-cyclohexyl-3-oxopropyl)-1-cyclopropylpyrrolidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 147422371
N-[(3R)-1-(2-oxo-1H-pyrazin-3-yl)piperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 129476803
N-[[(2R)-4-(1-cyclobutylpiperidin-4-yl)-5-oxomorpholin-2-yl]methyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 125177978
5-propan-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazole-3-carboxamide
CID 70709515
N-[(3R)-1-cyclohexylpiperidin-3-yl]-5-cyclopropyl-1,2-oxazole-3-carboxamide
CID 124863950
N,N-dicyclohexyl-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 17253281

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-[(3R)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide (CID 124738558) is N-[(3R)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-[(3R)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-[(3R)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide is CC(C)c1cc(C(=O)N[C@@H]2CCCN(C3CCCCC3)C2=O)no1.
What is the InChIKey of N-[(3R)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide?
The InChIKey is RAIWQEYUMFAQFI-CQSZACIVSA-N. The full InChI is InChI=1S/C18H27N3O3/c1-12(2)16-11-15(20-24-16)17(22)19-14-9-6-10-21(18(14)23)13-7-4-3-5-8-13/h11-14H,3-10H2,1-2H3,(H,19,22)/t14-/m1/s1.
What are the key properties of N-[(3R)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide?
N-[(3R)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide has a molecular weight of 333.43 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-1-cyclohexyl-2-oxopiperidin-3-yl]-5-propan-2-yl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 124738558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).