tert-butyl N-(1-morpholin-2-ylcyclopropyl)carbamate

C12H22N2O3 — CID 175669668

IUPACtert-butyl N-(1-morpholin-2-ylcyclopropyl)carbamate
SMILESCC(C)(C)OC(=O)NC1(C2CNCCO2)CC1
InChIInChI=1S/C12H22N2O3/c1-11(2,3)17-10(15)14-12(4-5-12)9-8-13-6-7-16-9/h9,13H,4-8H2,1-3H3,(H,14,15)
InChIKeyBXHHXVDONPOYIY-UHFFFAOYSA-N
MW242.32 g/mol
LogP1.03
Rot. Bonds2

About tert-butyl N-(1-morpholin-2-ylcyclopropyl)carbamate

tert-butyl N-(1-morpholin-2-ylcyclopropyl)carbamate (PubChem CID 175669668) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is tert-butyl N-(1-morpholin-2-ylcyclopropyl)carbamate.

Molecular Properties

Compound Nametert-butyl N-(1-morpholin-2-ylcyclopropyl)carbamate
PubChem CID175669668
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC Nametert-butyl N-(1-morpholin-2-ylcyclopropyl)carbamate
SMILESCC(C)(C)OC(=O)NC1(C2CNCCO2)CC1
InChIInChI=1S/C12H22N2O3/c1-11(2,3)17-10(15)14-12(4-5-12)9-8-13-6-7-16-9/h9,13H,4-8H2,1-3H3,(H,14,15)
InChIKeyBXHHXVDONPOYIY-UHFFFAOYSA-N
XLogP1.03
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl N-(3-azabicyclo[4.1.0]heptan-6-yl)carbamate
CID 59776920
tert-butyl N-[1-[(3R)-pyrrolidin-3-yl]cyclopropyl]carbamate;oxalic acid
CID 67340995
tert-butyl N-[[(2S)-morpholin-2-yl]methyl]carbamate
CID 42556133
tert-butyl N-(4-morpholin-2-ylphenyl)carbamate
CID 117446363
tert-butyl N-(2,3,4,6,7,7a-hexahydro-1H-pyrano[3,4-c]pyrrol-3a-yl)carbamate
CID 77301632
tert-butyl N-methyl-N-[(2S)-morpholin-2-yl]carbamate
CID 97056703
tert-butyl N-[(3S)-3-(trifluoromethyl)pyrrolidin-3-yl]carbamate
CID 92825862
tert-butyl N-(8-azaspiro[4.5]decan-10-yl)carbamate
CID 83680565
[(3S,4R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-4-yl]carbamic acid
CID 69017541
tert-butyl N-[(3S,4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidin-3-yl]carbamate
CID 24728871
6-[(2-methylpropan-2-yl)oxycarbonylamino]-3-azabicyclo[3.1.0]hexane-6-carboxylic acid
CID 83679887
tert-butyl N-(2,3-dimethyl-5-morpholin-2-ylphenyl)carbamate
CID 115111844

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(1-morpholin-2-ylcyclopropyl)carbamate?
The IUPAC name of tert-butyl N-(1-morpholin-2-ylcyclopropyl)carbamate (CID 175669668) is tert-butyl N-(1-morpholin-2-ylcyclopropyl)carbamate.
What is the SMILES notation for tert-butyl N-(1-morpholin-2-ylcyclopropyl)carbamate?
The canonical SMILES for tert-butyl N-(1-morpholin-2-ylcyclopropyl)carbamate is CC(C)(C)OC(=O)NC1(C2CNCCO2)CC1.
What is the InChIKey of tert-butyl N-(1-morpholin-2-ylcyclopropyl)carbamate?
The InChIKey is BXHHXVDONPOYIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3/c1-11(2,3)17-10(15)14-12(4-5-12)9-8-13-6-7-16-9/h9,13H,4-8H2,1-3H3,(H,14,15).
What are the key properties of tert-butyl N-(1-morpholin-2-ylcyclopropyl)carbamate?
tert-butyl N-(1-morpholin-2-ylcyclopropyl)carbamate has a molecular weight of 242.32 g/mol, XLogP of 1.03, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(1-morpholin-2-ylcyclopropyl)carbamate is sourced from PubChem (CID 175669668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).