(4-amino-6-oxopiperidin-3-yl) carbamate

C6H11N3O3 — CID 175060325

IUPAC(4-amino-6-oxopiperidin-3-yl) carbamate
SMILESNC(=O)OC1CNC(=O)CC1N
InChIInChI=1S/C6H11N3O3/c7-3-1-5(10)9-2-4(3)12-6(8)11/h3-4H,1-2,7H2,(H2,8,11)(H,9,10)
InChIKeyQRNKEZUGLMAXPH-UHFFFAOYSA-N
MW173.17 g/mol
LogP-1.70
Rot. Bonds1

About (4-amino-6-oxopiperidin-3-yl) carbamate

(4-amino-6-oxopiperidin-3-yl) carbamate (PubChem CID 175060325) has the molecular formula C6H11N3O3 and a molecular weight of 173.17 g/mol. Its IUPAC name is (4-amino-6-oxopiperidin-3-yl) carbamate.

Molecular Properties

Compound Name(4-amino-6-oxopiperidin-3-yl) carbamate
PubChem CID175060325
Molecular FormulaC6H11N3O3
Molecular Weight173.17 g/mol
Exact Mass173.08
IUPAC Name(4-amino-6-oxopiperidin-3-yl) carbamate
SMILESNC(=O)OC1CNC(=O)CC1N
InChIInChI=1S/C6H11N3O3/c7-3-1-5(10)9-2-4(3)12-6(8)11/h3-4H,1-2,7H2,(H2,8,11)(H,9,10)
InChIKeyQRNKEZUGLMAXPH-UHFFFAOYSA-N
XLogP-1.70
TPSA107.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.17
LogP ≤ 5-1.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-5-hydroxypiperidin-2-one
CID 131579230
(2-oxopiperidin-4-yl) carbamate
CID 155270724
[(4S,5R)-5-amino-2-oxopiperidin-4-yl]carbamic acid
CID 90426122
(4R)-4-aminopyrrolidin-2-one;dihydrochloride
CID 121000296
[(1R,2R)-2-aminocyclohexyl] carbamate
CID 145235379
[(3R,4S)-4-amino-6-oxopiperidin-3-yl]-tert-butylcarbamic acid
CID 118874617
(4-aminooxolan-3-yl) carbamate
CID 90426775
[(3S,4S)-4-hydroxypyrrolidin-3-yl] carbamate
CID 89405614
[(1R,2R)-2-methylcyclopropyl] carbamate
CID 171719227
(4S)-4-sulfanylpyrrolidin-2-one
CID 10486830
[(4R,5R)-5-amino-2-oxopiperidin-4-yl]-tert-butylcarbamic acid
CID 118874609
(4S,5R)-4,5-dihydroxypiperidin-2-one
CID 57413174

Frequently Asked Questions

What is the IUPAC name of (4-amino-6-oxopiperidin-3-yl) carbamate?
The IUPAC name of (4-amino-6-oxopiperidin-3-yl) carbamate (CID 175060325) is (4-amino-6-oxopiperidin-3-yl) carbamate.
What is the SMILES notation for (4-amino-6-oxopiperidin-3-yl) carbamate?
The canonical SMILES for (4-amino-6-oxopiperidin-3-yl) carbamate is NC(=O)OC1CNC(=O)CC1N.
What is the InChIKey of (4-amino-6-oxopiperidin-3-yl) carbamate?
The InChIKey is QRNKEZUGLMAXPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O3/c7-3-1-5(10)9-2-4(3)12-6(8)11/h3-4H,1-2,7H2,(H2,8,11)(H,9,10).
What are the key properties of (4-amino-6-oxopiperidin-3-yl) carbamate?
(4-amino-6-oxopiperidin-3-yl) carbamate has a molecular weight of 173.17 g/mol, XLogP of -1.70, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-6-oxopiperidin-3-yl) carbamate is sourced from PubChem (CID 175060325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).