tert-butyl N-[(3R)-1-(cyclobutanecarbonyl)piperidin-3-yl]carbamate

C15H26N2O3 — CID 66925793

IUPACtert-butyl N-[(3R)-1-(cyclobutanecarbonyl)piperidin-3-yl]carbamate
SMILESCC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)C2CCC2)C1
InChIInChI=1S/C15H26N2O3/c1-15(2,3)20-14(19)16-12-8-5-9-17(10-12)13(18)11-6-4-7-11/h11-12H,4-10H2,1-3H3,(H,16,19)/t12-/m1/s1
InChIKeyPYWICHSLYBFTST-GFCCVEGCSA-N
MW282.38 g/mol
LogP2.30
Rot. Bonds2

About tert-butyl N-[(3R)-1-(cyclobutanecarbonyl)piperidin-3-yl]carbamate

tert-butyl N-[(3R)-1-(cyclobutanecarbonyl)piperidin-3-yl]carbamate (PubChem CID 66925793) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is tert-butyl N-[(3R)-1-(cyclobutanecarbonyl)piperidin-3-yl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[(3R)-1-(cyclobutanecarbonyl)piperidin-3-yl]carbamate
PubChem CID66925793
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Nametert-butyl N-[(3R)-1-(cyclobutanecarbonyl)piperidin-3-yl]carbamate
SMILESCC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)C2CCC2)C1
InChIInChI=1S/C15H26N2O3/c1-15(2,3)20-14(19)16-12-8-5-9-17(10-12)13(18)11-6-4-7-11/h11-12H,4-10H2,1-3H3,(H,16,19)/t12-/m1/s1
InChIKeyPYWICHSLYBFTST-GFCCVEGCSA-N
XLogP2.30
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl N-[1-(cyclobutanecarbonyl)pyrrolidin-3-yl]carbamate
CID 75994018
tert-butyl (3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]azepane-1-carboxylate
CID 171397391
4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidine-1-carbonyl]piperidine-1-carboxylic acid
CID 129278997
tert-butyl N-[(1R,3S)-3-(4-methylpiperazine-1-carbonyl)cyclohexyl]carbamate
CID 129306101
tert-butyl N-[1-(2-chloroacetyl)piperidin-3-yl]carbamate
CID 66566123
tert-butyl N-[(3S)-1-(prop-2-ynylcarbamoyl)piperidin-3-yl]carbamate
CID 94193162
tert-butyl N-[3-(piperidine-1-carbonyl)cyclobutyl]carbamate
CID 158395553
tert-butyl N-(1-hydroxyazepan-3-yl)carbamate
CID 70285505
tert-butyl N-(1-acetylazepan-4-yl)carbamate
CID 123656997
ethyl 3-[(3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]-3-oxopropanoate
CID 174735969
tert-butyl N-[(3R)-1-cyclopropylpiperidin-3-yl]carbamate
CID 95912362
tert-butyl N-[(3R)-1-(2-methylpropylcarbamoyl)piperidin-3-yl]carbamate
CID 94648216

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[(3R)-1-(cyclobutanecarbonyl)piperidin-3-yl]carbamate?
The IUPAC name of tert-butyl N-[(3R)-1-(cyclobutanecarbonyl)piperidin-3-yl]carbamate (CID 66925793) is tert-butyl N-[(3R)-1-(cyclobutanecarbonyl)piperidin-3-yl]carbamate.
What is the SMILES notation for tert-butyl N-[(3R)-1-(cyclobutanecarbonyl)piperidin-3-yl]carbamate?
The canonical SMILES for tert-butyl N-[(3R)-1-(cyclobutanecarbonyl)piperidin-3-yl]carbamate is CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)C2CCC2)C1.
What is the InChIKey of tert-butyl N-[(3R)-1-(cyclobutanecarbonyl)piperidin-3-yl]carbamate?
The InChIKey is PYWICHSLYBFTST-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-15(2,3)20-14(19)16-12-8-5-9-17(10-12)13(18)11-6-4-7-11/h11-12H,4-10H2,1-3H3,(H,16,19)/t12-/m1/s1.
What are the key properties of tert-butyl N-[(3R)-1-(cyclobutanecarbonyl)piperidin-3-yl]carbamate?
tert-butyl N-[(3R)-1-(cyclobutanecarbonyl)piperidin-3-yl]carbamate has a molecular weight of 282.38 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[(3R)-1-(cyclobutanecarbonyl)piperidin-3-yl]carbamate is sourced from PubChem (CID 66925793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).