ethyl 4-[2-(ethylamino)-3-oxopentyl]piperidine-1-carboxylate

C15H28N2O3 — CID 71154690

IUPACethyl 4-[2-(ethylamino)-3-oxopentyl]piperidine-1-carboxylate
SMILESCCNC(CC1CCN(C(=O)OCC)CC1)C(=O)CC
InChIInChI=1S/C15H28N2O3/c1-4-14(18)13(16-5-2)11-12-7-9-17(10-8-12)15(19)20-6-3/h12-13,16H,4-11H2,1-3H3
InChIKeyINFZOJRUXUUZMV-UHFFFAOYSA-N
MW284.40 g/mol
LogP2.20
Rot. Bonds7

About ethyl 4-[2-(ethylamino)-3-oxopentyl]piperidine-1-carboxylate

ethyl 4-[2-(ethylamino)-3-oxopentyl]piperidine-1-carboxylate (PubChem CID 71154690) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is ethyl 4-[2-(ethylamino)-3-oxopentyl]piperidine-1-carboxylate.

Molecular Properties

Compound Nameethyl 4-[2-(ethylamino)-3-oxopentyl]piperidine-1-carboxylate
PubChem CID71154690
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC Nameethyl 4-[2-(ethylamino)-3-oxopentyl]piperidine-1-carboxylate
SMILESCCNC(CC1CCN(C(=O)OCC)CC1)C(=O)CC
InChIInChI=1S/C15H28N2O3/c1-4-14(18)13(16-5-2)11-12-7-9-17(10-8-12)15(19)20-6-3/h12-13,16H,4-11H2,1-3H3
InChIKeyINFZOJRUXUUZMV-UHFFFAOYSA-N
XLogP2.20
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethylamino)-1-(1-methylpiperidin-4-yl)pentan-3-one
CID 71154625
1-(4,4-dimethylcyclohexyl)-2-(ethylamino)pentan-3-one
CID 71154495
3-(1-ethoxycarbonylpiperidin-4-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
CID 20825377
2-methylpropyl 4-(2-amino-3-ethoxy-3-oxopropyl)piperidine-1-carboxylate
CID 67123498
ethyl 4-[(1-amino-1-oxobutan-2-yl)amino]piperidine-1-carboxylate
CID 62899266
2-[(1-ethoxycarbonylpiperidin-4-yl)amino]butanoic acid
CID 64667745
2-methylpropyl 4-propan-2-ylpiperidine-1-carboxylate
CID 21025591
ethyl 4-[2-(cyclopropylmethylamino)acetyl]piperazine-1-carboxylate
CID 54916262
ethyl 4-(3-methylbutan-2-ylamino)piperidine-1-carboxylate
CID 43196751
ethyl 4-(4-hydroxybutyl)piperidine-1-carboxylate
CID 19748294
methyl 4-(2-ethoxy-2-oxoethyl)piperidine-1-carboxylate
CID 143987210
ethyl 4-[[(1S)-1-cycloheptylethyl]amino]piperidine-1-carboxylate
CID 81390651

Frequently Asked Questions

What is the IUPAC name of ethyl 4-[2-(ethylamino)-3-oxopentyl]piperidine-1-carboxylate?
The IUPAC name of ethyl 4-[2-(ethylamino)-3-oxopentyl]piperidine-1-carboxylate (CID 71154690) is ethyl 4-[2-(ethylamino)-3-oxopentyl]piperidine-1-carboxylate.
What is the SMILES notation for ethyl 4-[2-(ethylamino)-3-oxopentyl]piperidine-1-carboxylate?
The canonical SMILES for ethyl 4-[2-(ethylamino)-3-oxopentyl]piperidine-1-carboxylate is CCNC(CC1CCN(C(=O)OCC)CC1)C(=O)CC.
What is the InChIKey of ethyl 4-[2-(ethylamino)-3-oxopentyl]piperidine-1-carboxylate?
The InChIKey is INFZOJRUXUUZMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-4-14(18)13(16-5-2)11-12-7-9-17(10-8-12)15(19)20-6-3/h12-13,16H,4-11H2,1-3H3.
What are the key properties of ethyl 4-[2-(ethylamino)-3-oxopentyl]piperidine-1-carboxylate?
ethyl 4-[2-(ethylamino)-3-oxopentyl]piperidine-1-carboxylate has a molecular weight of 284.40 g/mol, XLogP of 2.20, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-[2-(ethylamino)-3-oxopentyl]piperidine-1-carboxylate is sourced from PubChem (CID 71154690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).