tert-butyl 4-[cyclopropanecarbonyl(methyl)amino]piperidine-1-carboxylate

C15H26N2O3 — CID 154576447

IUPACtert-butyl 4-[cyclopropanecarbonyl(methyl)amino]piperidine-1-carboxylate
SMILESCN(C(=O)C1CC1)C1CCN(C(=O)OC(C)(C)C)CC1
InChIInChI=1S/C15H26N2O3/c1-15(2,3)20-14(19)17-9-7-12(8-10-17)16(4)13(18)11-5-6-11/h11-12H,5-10H2,1-4H3
InChIKeySUFXZRVRFHBRDZ-UHFFFAOYSA-N
MW282.38 g/mol
LogP2.25
Rot. Bonds2

About tert-butyl 4-[cyclopropanecarbonyl(methyl)amino]piperidine-1-carboxylate

tert-butyl 4-[cyclopropanecarbonyl(methyl)amino]piperidine-1-carboxylate (PubChem CID 154576447) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is tert-butyl 4-[cyclopropanecarbonyl(methyl)amino]piperidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl 4-[cyclopropanecarbonyl(methyl)amino]piperidine-1-carboxylate
PubChem CID154576447
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Nametert-butyl 4-[cyclopropanecarbonyl(methyl)amino]piperidine-1-carboxylate
SMILESCN(C(=O)C1CC1)C1CCN(C(=O)OC(C)(C)C)CC1
InChIInChI=1S/C15H26N2O3/c1-15(2,3)20-14(19)17-9-7-12(8-10-17)16(4)13(18)11-5-6-11/h11-12H,5-10H2,1-4H3
InChIKeySUFXZRVRFHBRDZ-UHFFFAOYSA-N
XLogP2.25
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl 4-[methoxycarbonyl(methyl)amino]piperidine-1-carboxylate
CID 18187514
tert-butyl 4-[methyl(sulfamoyl)amino]piperidine-1-carboxylate
CID 167049164
methyl-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]carbamic acid
CID 77225686
tert-butyl 4-propan-2-ylpiperidine-1-carboxylate
CID 22899309
tert-butyl 4-[amino(ethanehydrazonoyl)amino]piperidine-1-carboxylate
CID 135161885
tert-butyl 3-[carbamoyl(methyl)amino]pyrrolidine-1-carboxylate
CID 66758447
tert-butyl 4-[bicyclo[4.2.0]octa-1,3,5-triene-7-carbonyl(methyl)amino]piperidine-1-carboxylate
CID 84584797
tert-butyl 4-aminosulfanylpiperidine-1-carboxylate
CID 135202849
tert-butyl 4-[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]piperidine-1-carboxylate
CID 42941581
tert-butyl 4-[carbamoyl(sulfanyl)amino]piperidine-1-carboxylate
CID 87593874
tert-butyl 4-[methoxy(methyl)carbamoyl]piperidine-1-carboxylate;methoxyethane;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid
CID 160695489
tert-butyl 4-[ethyl(2-hydroxyethyl)carbamoyl]piperidine-1-carboxylate
CID 78855436

Frequently Asked Questions

What is the IUPAC name of tert-butyl 4-[cyclopropanecarbonyl(methyl)amino]piperidine-1-carboxylate?
The IUPAC name of tert-butyl 4-[cyclopropanecarbonyl(methyl)amino]piperidine-1-carboxylate (CID 154576447) is tert-butyl 4-[cyclopropanecarbonyl(methyl)amino]piperidine-1-carboxylate.
What is the SMILES notation for tert-butyl 4-[cyclopropanecarbonyl(methyl)amino]piperidine-1-carboxylate?
The canonical SMILES for tert-butyl 4-[cyclopropanecarbonyl(methyl)amino]piperidine-1-carboxylate is CN(C(=O)C1CC1)C1CCN(C(=O)OC(C)(C)C)CC1.
What is the InChIKey of tert-butyl 4-[cyclopropanecarbonyl(methyl)amino]piperidine-1-carboxylate?
The InChIKey is SUFXZRVRFHBRDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-15(2,3)20-14(19)17-9-7-12(8-10-17)16(4)13(18)11-5-6-11/h11-12H,5-10H2,1-4H3.
What are the key properties of tert-butyl 4-[cyclopropanecarbonyl(methyl)amino]piperidine-1-carboxylate?
tert-butyl 4-[cyclopropanecarbonyl(methyl)amino]piperidine-1-carboxylate has a molecular weight of 282.38 g/mol, XLogP of 2.25, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 4-[cyclopropanecarbonyl(methyl)amino]piperidine-1-carboxylate is sourced from PubChem (CID 154576447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).