ethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate

C13H20N2O4 — CID 112502966

IUPACethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate
SMILESCCOC(=O)NCC(c1ccco1)N1CCOCC1
InChIInChI=1S/C13H20N2O4/c1-2-18-13(16)14-10-11(12-4-3-7-19-12)15-5-8-17-9-6-15/h3-4,7,11H,2,5-6,8-10H2,1H3,(H,14,16)
InChIKeyUSMDDQHQONZYRL-UHFFFAOYSA-N
MW268.31 g/mol
LogP1.40
Rot. Bonds5

About ethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate

ethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate (PubChem CID 112502966) has the molecular formula C13H20N2O4 and a molecular weight of 268.31 g/mol. Its IUPAC name is ethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate.

Molecular Properties

Compound Nameethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate
PubChem CID112502966
Molecular FormulaC13H20N2O4
Molecular Weight268.31 g/mol
Exact Mass268.14
IUPAC Nameethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate
SMILESCCOC(=O)NCC(c1ccco1)N1CCOCC1
InChIInChI=1S/C13H20N2O4/c1-2-18-13(16)14-10-11(12-4-3-7-19-12)15-5-8-17-9-6-15/h3-4,7,11H,2,5-6,8-10H2,1H3,(H,14,16)
InChIKeyUSMDDQHQONZYRL-UHFFFAOYSA-N
XLogP1.40
TPSA63.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.31
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2S)-2-(furan-2-yl)-2-morpholin-4-ylethyl]butanamide
CID 26819488
ethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate
CID 110314125
N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbenzamide;hydrochloride
CID 52984760
ethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate
CID 112502614
N-(furan-2-ylmethyl)-N'-[(2S)-2-(furan-2-yl)-2-morpholin-4-ylethyl]oxamide
CID 7217319
N-[2-(dimethylamino)ethyl]-N'-[2-(furan-2-yl)-2-morpholin-4-ylethyl]oxamide
CID 121036180
2-(2,3-dimethylphenoxy)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]acetamide
CID 23608308
N-benzyl-N'-[(2R)-2-(furan-2-yl)-2-morpholin-4-ylethyl]oxamide
CID 7217143
N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-(2-methoxyphenoxy)acetamide
CID 17014506
N-[(2R)-2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-(2-methoxyphenoxy)acetamide
CID 26819379
N'-[(2R)-2-(furan-2-yl)-2-morpholin-4-ylethyl]-N-[(4-methoxyphenyl)methyl]oxamide
CID 7217228
2-(3,4-dimethylphenoxy)-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]propanamide;hydrochloride
CID 52985251

Frequently Asked Questions

What is the IUPAC name of ethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate?
The IUPAC name of ethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate (CID 112502966) is ethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate.
What is the SMILES notation for ethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate?
The canonical SMILES for ethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate is CCOC(=O)NCC(c1ccco1)N1CCOCC1.
What is the InChIKey of ethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate?
The InChIKey is USMDDQHQONZYRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O4/c1-2-18-13(16)14-10-11(12-4-3-7-19-12)15-5-8-17-9-6-15/h3-4,7,11H,2,5-6,8-10H2,1H3,(H,14,16).
What are the key properties of ethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate?
ethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate has a molecular weight of 268.31 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate is sourced from PubChem (CID 112502966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).