methyl (2R)-1-[(3-methoxyphenyl)carbamoyl]piperidine-2-carboxylate

C15H20N2O4 — CID 115536153

IUPACmethyl (2R)-1-[(3-methoxyphenyl)carbamoyl]piperidine-2-carboxylate
SMILESCOC(=O)[C@H]1CCCCN1C(=O)Nc1cccc(OC)c1
InChIInChI=1S/C15H20N2O4/c1-20-12-7-5-6-11(10-12)16-15(19)17-9-4-3-8-13(17)14(18)21-2/h5-7,10,13H,3-4,8-9H2,1-2H3,(H,16,19)/t13-/m1/s1
InChIKeyYKAMXOUNLGUDCR-CYBMUJFWSA-N
MW292.33 g/mol
LogP2.25
Rot. Bonds3

About methyl (2R)-1-[(3-methoxyphenyl)carbamoyl]piperidine-2-carboxylate

methyl (2R)-1-[(3-methoxyphenyl)carbamoyl]piperidine-2-carboxylate (PubChem CID 115536153) has the molecular formula C15H20N2O4 and a molecular weight of 292.33 g/mol. Its IUPAC name is methyl (2R)-1-[(3-methoxyphenyl)carbamoyl]piperidine-2-carboxylate.

Molecular Properties

Compound Namemethyl (2R)-1-[(3-methoxyphenyl)carbamoyl]piperidine-2-carboxylate
PubChem CID115536153
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC Namemethyl (2R)-1-[(3-methoxyphenyl)carbamoyl]piperidine-2-carboxylate
SMILESCOC(=O)[C@H]1CCCCN1C(=O)Nc1cccc(OC)c1
InChIInChI=1S/C15H20N2O4/c1-20-12-7-5-6-11(10-12)16-15(19)17-9-4-3-8-13(17)14(18)21-2/h5-7,10,13H,3-4,8-9H2,1-2H3,(H,16,19)/t13-/m1/s1
InChIKeyYKAMXOUNLGUDCR-CYBMUJFWSA-N
XLogP2.25
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-1-N,2-N-bis(3-methoxyphenyl)pyrrolidine-1,2-dicarboxamide
CID 1468886
(2S)-2-N-cyclopentyl-1-N-(3-methoxyphenyl)pyrrolidine-1,2-dicarboxamide
CID 1433458
(2R)-2-N-(3-methoxyphenyl)-1-N-phenylpyrrolidine-1,2-dicarboxamide
CID 51552699
2-N-(3-methoxyphenyl)-1-N-phenylpyrrolidine-1,2-dicarboxamide
CID 24792717
1-N-(3-methoxyphenyl)-2-N-prop-2-enylpyrrolidine-1,2-dicarboxamide
CID 4998458
(2R)-2-N-(4-fluorophenyl)-1-N-(3-methoxyphenyl)pyrrolidine-1,2-dicarboxamide
CID 1468879
(2S)-2-[(1S)-1-hydroxypropyl]-N-(3-methoxyphenyl)piperidine-1-carboxamide
CID 95980216
methyl 1-[(3,4-dichlorophenyl)carbamoyl]piperidine-2-carboxylate
CID 78915612
methyl (2R)-1-[(3-chloro-4-methylphenyl)carbamoyl]piperidine-2-carboxylate
CID 115536142
(2R)-2-N-(4-acetylphenyl)-1-N-(3-methoxyphenyl)pyrrolidine-1,2-dicarboxamide
CID 51426368
1-N-(3-methoxyphenyl)-2-N-(2-methylpropyl)pyrrolidine-1,2-dicarboxamide
CID 646616
1-N-(3-methoxyphenyl)-2-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide
CID 3219782

Frequently Asked Questions

What is the IUPAC name of methyl (2R)-1-[(3-methoxyphenyl)carbamoyl]piperidine-2-carboxylate?
The IUPAC name of methyl (2R)-1-[(3-methoxyphenyl)carbamoyl]piperidine-2-carboxylate (CID 115536153) is methyl (2R)-1-[(3-methoxyphenyl)carbamoyl]piperidine-2-carboxylate.
What is the SMILES notation for methyl (2R)-1-[(3-methoxyphenyl)carbamoyl]piperidine-2-carboxylate?
The canonical SMILES for methyl (2R)-1-[(3-methoxyphenyl)carbamoyl]piperidine-2-carboxylate is COC(=O)[C@H]1CCCCN1C(=O)Nc1cccc(OC)c1.
What is the InChIKey of methyl (2R)-1-[(3-methoxyphenyl)carbamoyl]piperidine-2-carboxylate?
The InChIKey is YKAMXOUNLGUDCR-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-20-12-7-5-6-11(10-12)16-15(19)17-9-4-3-8-13(17)14(18)21-2/h5-7,10,13H,3-4,8-9H2,1-2H3,(H,16,19)/t13-/m1/s1.
What are the key properties of methyl (2R)-1-[(3-methoxyphenyl)carbamoyl]piperidine-2-carboxylate?
methyl (2R)-1-[(3-methoxyphenyl)carbamoyl]piperidine-2-carboxylate has a molecular weight of 292.33 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (2R)-1-[(3-methoxyphenyl)carbamoyl]piperidine-2-carboxylate is sourced from PubChem (CID 115536153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).