(2R)-2-(1,3-dioxolan-2-yl)-N-(2-ethoxy-4-methylphenyl)piperidine-1-carboxamide

C18H26N2O4 — CID 95319052

IUPAC(2R)-2-(1,3-dioxolan-2-yl)-N-(2-ethoxy-4-methylphenyl)piperidine-1-carboxamide
SMILESCCOc1cc(C)ccc1NC(=O)N1CCCC[C@@H]1C1OCCO1
InChIInChI=1S/C18H26N2O4/c1-3-22-16-12-13(2)7-8-14(16)19-18(21)20-9-5-4-6-15(20)17-23-10-11-24-17/h7-8,12,15,17H,3-6,9-11H2,1-2H3,(H,19,21)/t15-/m1/s1
InChIKeyUHZKVXNABPLDFS-OAHLLOKOSA-N
MW334.42 g/mol
LogP3.15
Rot. Bonds4

About (2R)-2-(1,3-dioxolan-2-yl)-N-(2-ethoxy-4-methylphenyl)piperidine-1-carboxamide

(2R)-2-(1,3-dioxolan-2-yl)-N-(2-ethoxy-4-methylphenyl)piperidine-1-carboxamide (PubChem CID 95319052) has the molecular formula C18H26N2O4 and a molecular weight of 334.42 g/mol. Its IUPAC name is (2R)-2-(1,3-dioxolan-2-yl)-N-(2-ethoxy-4-methylphenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name(2R)-2-(1,3-dioxolan-2-yl)-N-(2-ethoxy-4-methylphenyl)piperidine-1-carboxamide
PubChem CID95319052
Molecular FormulaC18H26N2O4
Molecular Weight334.42 g/mol
Exact Mass334.19
IUPAC Name(2R)-2-(1,3-dioxolan-2-yl)-N-(2-ethoxy-4-methylphenyl)piperidine-1-carboxamide
SMILESCCOc1cc(C)ccc1NC(=O)N1CCCC[C@@H]1C1OCCO1
InChIInChI=1S/C18H26N2O4/c1-3-22-16-12-13(2)7-8-14(16)19-18(21)20-9-5-4-6-15(20)17-23-10-11-24-17/h7-8,12,15,17H,3-6,9-11H2,1-2H3,(H,19,21)/t15-/m1/s1
InChIKeyUHZKVXNABPLDFS-OAHLLOKOSA-N
XLogP3.15
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-ethoxy-4-methylphenyl)-2-methylmorpholine-4-carboxamide
CID 47262001
N-(2-ethoxyphenyl)-2-ethylpiperidine-1-carboxamide
CID 6468578
N-(4-methyl-2-propoxyphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide
CID 87010188
2-[(2-ethoxy-4-methylphenyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103978084
N-(2-ethoxy-4-fluorophenyl)-2-(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)piperidine-1-carboxamide
CID 136556101
N-[2-(2-methoxyethoxy)-4-methylphenyl]pyrrolidine-1-carboxamide
CID 47262655
(2R)-N-(2-ethoxy-4-methylphenyl)pyrrolidine-2-carboxamide
CID 93360332
5-[(2-ethoxy-4-methylphenyl)carbamoyl]oxolane-2-carboxylic acid
CID 102687855
(2R)-2-(1,3-dioxolan-2-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide
CID 95268925
4-[(2-ethoxy-4-methylphenyl)carbamoylamino]cyclohexane-1-carboxylic acid
CID 122076839
N-(2-ethoxy-4-methylphenyl)-3-(propan-2-ylamino)propanamide
CID 54862887
(2R)-N-(2-ethoxyphenyl)-2-thiophen-2-ylazepane-1-carboxamide
CID 92503136

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(1,3-dioxolan-2-yl)-N-(2-ethoxy-4-methylphenyl)piperidine-1-carboxamide?
The IUPAC name of (2R)-2-(1,3-dioxolan-2-yl)-N-(2-ethoxy-4-methylphenyl)piperidine-1-carboxamide (CID 95319052) is (2R)-2-(1,3-dioxolan-2-yl)-N-(2-ethoxy-4-methylphenyl)piperidine-1-carboxamide.
What is the SMILES notation for (2R)-2-(1,3-dioxolan-2-yl)-N-(2-ethoxy-4-methylphenyl)piperidine-1-carboxamide?
The canonical SMILES for (2R)-2-(1,3-dioxolan-2-yl)-N-(2-ethoxy-4-methylphenyl)piperidine-1-carboxamide is CCOc1cc(C)ccc1NC(=O)N1CCCC[C@@H]1C1OCCO1.
What is the InChIKey of (2R)-2-(1,3-dioxolan-2-yl)-N-(2-ethoxy-4-methylphenyl)piperidine-1-carboxamide?
The InChIKey is UHZKVXNABPLDFS-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H26N2O4/c1-3-22-16-12-13(2)7-8-14(16)19-18(21)20-9-5-4-6-15(20)17-23-10-11-24-17/h7-8,12,15,17H,3-6,9-11H2,1-2H3,(H,19,21)/t15-/m1/s1.
What are the key properties of (2R)-2-(1,3-dioxolan-2-yl)-N-(2-ethoxy-4-methylphenyl)piperidine-1-carboxamide?
(2R)-2-(1,3-dioxolan-2-yl)-N-(2-ethoxy-4-methylphenyl)piperidine-1-carboxamide has a molecular weight of 334.42 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(1,3-dioxolan-2-yl)-N-(2-ethoxy-4-methylphenyl)piperidine-1-carboxamide is sourced from PubChem (CID 95319052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).