propan-2-yl N-ethyl-N-(3-hydroxyphenyl)carbamate

C12H17NO3 — CID 107734181

IUPACpropan-2-yl N-ethyl-N-(3-hydroxyphenyl)carbamate
SMILESCCN(C(=O)OC(C)C)c1cccc(O)c1
InChIInChI=1S/C12H17NO3/c1-4-13(12(15)16-9(2)3)10-6-5-7-11(14)8-10/h5-9,14H,4H2,1-3H3
InChIKeyHGHFGDWFBKNIEY-UHFFFAOYSA-N
MW223.27 g/mol
LogP2.76
Rot. Bonds3

About propan-2-yl N-ethyl-N-(3-hydroxyphenyl)carbamate

propan-2-yl N-ethyl-N-(3-hydroxyphenyl)carbamate (PubChem CID 107734181) has the molecular formula C12H17NO3 and a molecular weight of 223.27 g/mol. Its IUPAC name is propan-2-yl N-ethyl-N-(3-hydroxyphenyl)carbamate.

Molecular Properties

Compound Namepropan-2-yl N-ethyl-N-(3-hydroxyphenyl)carbamate
PubChem CID107734181
Molecular FormulaC12H17NO3
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC Namepropan-2-yl N-ethyl-N-(3-hydroxyphenyl)carbamate
SMILESCCN(C(=O)OC(C)C)c1cccc(O)c1
InChIInChI=1S/C12H17NO3/c1-4-13(12(15)16-9(2)3)10-6-5-7-11(14)8-10/h5-9,14H,4H2,1-3H3
InChIKeyHGHFGDWFBKNIEY-UHFFFAOYSA-N
XLogP2.76
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl N-ethyl-N-(3-hydroxyphenyl)carbamate
CID 107734186
propan-2-yl N-ethyl-N-[3-(trifluoromethyl)phenyl]carbamate
CID 140972623
N-ethyl-N-(3-hydroxyphenyl)-2-propan-2-yloxyacetamide
CID 107736354
ethyl-(3-hydroxyphenyl)carbamic acid
CID 20544636
N-ethyl-N-(3-hydroxyphenyl)-3-methylbutanamide
CID 107736260
propan-2-yl N-ethyl-N-pyridin-4-ylcarbamate
CID 106934812
2-amino-N-ethyl-N-(3-hydroxyphenyl)acetamide
CID 107734970
ethyl 2-amino-3-(N-ethyl-3-hydroxyanilino)-3-oxopropanoate
CID 107735006
N-ethyl-N,2-bis(3-hydroxyphenyl)acetamide
CID 107735678
4-amino-N-ethyl-N-(3-hydroxyphenyl)-3-methoxybutanamide
CID 107735030
N-ethyl-2-(2-hydroxyphenyl)-N-(3-hydroxyphenyl)acetamide
CID 107735690
6-amino-N-ethyl-N-(3-hydroxyphenyl)-2-methylheptanamide
CID 107734856

Frequently Asked Questions

What is the IUPAC name of propan-2-yl N-ethyl-N-(3-hydroxyphenyl)carbamate?
The IUPAC name of propan-2-yl N-ethyl-N-(3-hydroxyphenyl)carbamate (CID 107734181) is propan-2-yl N-ethyl-N-(3-hydroxyphenyl)carbamate.
What is the SMILES notation for propan-2-yl N-ethyl-N-(3-hydroxyphenyl)carbamate?
The canonical SMILES for propan-2-yl N-ethyl-N-(3-hydroxyphenyl)carbamate is CCN(C(=O)OC(C)C)c1cccc(O)c1.
What is the InChIKey of propan-2-yl N-ethyl-N-(3-hydroxyphenyl)carbamate?
The InChIKey is HGHFGDWFBKNIEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3/c1-4-13(12(15)16-9(2)3)10-6-5-7-11(14)8-10/h5-9,14H,4H2,1-3H3.
What are the key properties of propan-2-yl N-ethyl-N-(3-hydroxyphenyl)carbamate?
propan-2-yl N-ethyl-N-(3-hydroxyphenyl)carbamate has a molecular weight of 223.27 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl N-ethyl-N-(3-hydroxyphenyl)carbamate is sourced from PubChem (CID 107734181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).