ethyl 4-[(6-methoxypyridine-3-carbonyl)amino]piperidine-1-carboxylate

C15H21N3O4 — CID 31844781

IUPACethyl 4-[(6-methoxypyridine-3-carbonyl)amino]piperidine-1-carboxylate
SMILESCCOC(=O)N1CCC(NC(=O)c2ccc(OC)nc2)CC1
InChIInChI=1S/C15H21N3O4/c1-3-22-15(20)18-8-6-12(7-9-18)17-14(19)11-4-5-13(21-2)16-10-11/h4-5,10,12H,3,6-9H2,1-2H3,(H,17,19)
InChIKeyFQCKIBZVGQESLE-UHFFFAOYSA-N
MW307.35 g/mol
LogP1.44
Rot. Bonds4

About ethyl 4-[(6-methoxypyridine-3-carbonyl)amino]piperidine-1-carboxylate

ethyl 4-[(6-methoxypyridine-3-carbonyl)amino]piperidine-1-carboxylate (PubChem CID 31844781) has the molecular formula C15H21N3O4 and a molecular weight of 307.35 g/mol. Its IUPAC name is ethyl 4-[(6-methoxypyridine-3-carbonyl)amino]piperidine-1-carboxylate.

Molecular Properties

Compound Nameethyl 4-[(6-methoxypyridine-3-carbonyl)amino]piperidine-1-carboxylate
PubChem CID31844781
Molecular FormulaC15H21N3O4
Molecular Weight307.35 g/mol
Exact Mass307.15
IUPAC Nameethyl 4-[(6-methoxypyridine-3-carbonyl)amino]piperidine-1-carboxylate
SMILESCCOC(=O)N1CCC(NC(=O)c2ccc(OC)nc2)CC1
InChIInChI=1S/C15H21N3O4/c1-3-22-15(20)18-8-6-12(7-9-18)17-14(19)11-4-5-13(21-2)16-10-11/h4-5,10,12H,3,6-9H2,1-2H3,(H,17,19)
InChIKeyFQCKIBZVGQESLE-UHFFFAOYSA-N
XLogP1.44
TPSA80.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 4-[[4-[(1-ethoxycarbonylpiperidin-4-yl)carbamoyl]benzoyl]amino]piperidine-1-carboxylate
CID 24644255
ethyl 4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxylate
CID 31542192
N-[1-(furan-3-carbonyl)piperidin-4-yl]-6-methoxypyridine-3-carboxamide
CID 38214016
ethyl 4-[[5-(cyclopropylcarbamoyl)pyrimidin-2-yl]amino]piperidine-1-carboxylate
CID 109247316
ethyl 4-benzamidopiperidine-1-carboxylate
CID 18120666
ethyl 4-[[2-(4-methylanilino)pyrimidine-5-carbonyl]amino]piperidine-1-carboxylate
CID 109261809
ethyl 4-[(4-ethoxy-3-methylbenzoyl)amino]piperidine-1-carboxylate
CID 110762169
ethyl 4-[[6-(2,3-dihydroindol-1-yl)pyridine-3-carbonyl]amino]piperidine-1-carboxylate
CID 109160228
ethyl 4-[(2-morpholin-4-ylpyrimidine-5-carbonyl)amino]piperidine-1-carboxylate
CID 109252241
ethyl 4-[(4-cyanobenzoyl)amino]piperidine-1-carboxylate
CID 17473701
6-ethoxy-N-[1-(phenylcarbamoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 87034036
N-[4-(cyclopropylcarbamoyl)phenyl]-6-methoxypyridine-3-carboxamide
CID 51300111

Frequently Asked Questions

What is the IUPAC name of ethyl 4-[(6-methoxypyridine-3-carbonyl)amino]piperidine-1-carboxylate?
The IUPAC name of ethyl 4-[(6-methoxypyridine-3-carbonyl)amino]piperidine-1-carboxylate (CID 31844781) is ethyl 4-[(6-methoxypyridine-3-carbonyl)amino]piperidine-1-carboxylate.
What is the SMILES notation for ethyl 4-[(6-methoxypyridine-3-carbonyl)amino]piperidine-1-carboxylate?
The canonical SMILES for ethyl 4-[(6-methoxypyridine-3-carbonyl)amino]piperidine-1-carboxylate is CCOC(=O)N1CCC(NC(=O)c2ccc(OC)nc2)CC1.
What is the InChIKey of ethyl 4-[(6-methoxypyridine-3-carbonyl)amino]piperidine-1-carboxylate?
The InChIKey is FQCKIBZVGQESLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O4/c1-3-22-15(20)18-8-6-12(7-9-18)17-14(19)11-4-5-13(21-2)16-10-11/h4-5,10,12H,3,6-9H2,1-2H3,(H,17,19).
What are the key properties of ethyl 4-[(6-methoxypyridine-3-carbonyl)amino]piperidine-1-carboxylate?
ethyl 4-[(6-methoxypyridine-3-carbonyl)amino]piperidine-1-carboxylate has a molecular weight of 307.35 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-[(6-methoxypyridine-3-carbonyl)amino]piperidine-1-carboxylate is sourced from PubChem (CID 31844781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).