ethyl N-methyl-N-(1-propan-2-ylazetidin-3-yl)carbamate

C10H20N2O2 — CID 146427373

IUPACethyl N-methyl-N-(1-propan-2-ylazetidin-3-yl)carbamate
SMILESCCOC(=O)N(C)C1CN(C(C)C)C1
InChIInChI=1S/C10H20N2O2/c1-5-14-10(13)11(4)9-6-12(7-9)8(2)3/h8-9H,5-7H2,1-4H3
InChIKeyUBSRJDLSLFEYFJ-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.17
Rot. Bonds3

About ethyl N-methyl-N-(1-propan-2-ylazetidin-3-yl)carbamate

ethyl N-methyl-N-(1-propan-2-ylazetidin-3-yl)carbamate (PubChem CID 146427373) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is ethyl N-methyl-N-(1-propan-2-ylazetidin-3-yl)carbamate.

Molecular Properties

Compound Nameethyl N-methyl-N-(1-propan-2-ylazetidin-3-yl)carbamate
PubChem CID146427373
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Nameethyl N-methyl-N-(1-propan-2-ylazetidin-3-yl)carbamate
SMILESCCOC(=O)N(C)C1CN(C(C)C)C1
InChIInChI=1S/C10H20N2O2/c1-5-14-10(13)11(4)9-6-12(7-9)8(2)3/h8-9H,5-7H2,1-4H3
InChIKeyUBSRJDLSLFEYFJ-UHFFFAOYSA-N
XLogP1.17
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl N-methyl-N-(1-propan-2-ylazetidin-3-yl)carbamate?
The IUPAC name of ethyl N-methyl-N-(1-propan-2-ylazetidin-3-yl)carbamate (CID 146427373) is ethyl N-methyl-N-(1-propan-2-ylazetidin-3-yl)carbamate.
What is the SMILES notation for ethyl N-methyl-N-(1-propan-2-ylazetidin-3-yl)carbamate?
The canonical SMILES for ethyl N-methyl-N-(1-propan-2-ylazetidin-3-yl)carbamate is CCOC(=O)N(C)C1CN(C(C)C)C1.
What is the InChIKey of ethyl N-methyl-N-(1-propan-2-ylazetidin-3-yl)carbamate?
The InChIKey is UBSRJDLSLFEYFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-5-14-10(13)11(4)9-6-12(7-9)8(2)3/h8-9H,5-7H2,1-4H3.
What are the key properties of ethyl N-methyl-N-(1-propan-2-ylazetidin-3-yl)carbamate?
ethyl N-methyl-N-(1-propan-2-ylazetidin-3-yl)carbamate has a molecular weight of 200.28 g/mol, XLogP of 1.17, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-methyl-N-(1-propan-2-ylazetidin-3-yl)carbamate is sourced from PubChem (CID 146427373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).