(4-ethylphenyl) carbamate

C9H11NO2 — CID 1269945

IUPAC(4-ethylphenyl) carbamate
SMILESCCc1ccc(OC(N)=O)cc1
InChIInChI=1S/C9H11NO2/c1-2-7-3-5-8(6-4-7)12-9(10)11/h3-6H,2H2,1H3,(H2,10,11)
InChIKeyWBBJNNIOVSTUQP-UHFFFAOYSA-N
MW165.19 g/mol
LogP1.71
Rot. Bonds2

About (4-ethylphenyl) carbamate

(4-ethylphenyl) carbamate (PubChem CID 1269945) has the molecular formula C9H11NO2 and a molecular weight of 165.19 g/mol. Its IUPAC name is (4-ethylphenyl) carbamate.

Molecular Properties

Compound Name(4-ethylphenyl) carbamate
PubChem CID1269945
Molecular FormulaC9H11NO2
Molecular Weight165.19 g/mol
Exact Mass165.08
IUPAC Name(4-ethylphenyl) carbamate
SMILESCCc1ccc(OC(N)=O)cc1
InChIInChI=1S/C9H11NO2/c1-2-7-3-5-8(6-4-7)12-9(10)11/h3-6H,2H2,1H3,(H2,10,11)
InChIKeyWBBJNNIOVSTUQP-UHFFFAOYSA-N
XLogP1.71
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.19
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

bis(4-ethylphenyl) carbonate;carbonic acid
CID 159757999
2-(4-carbamoyloxyphenyl)acetic acid
CID 54293995
[4-[(2R)-2-aminopropyl]phenyl] carbamate
CID 66608683
[4-(2-aminopropyl)phenyl] carbamate
CID 57045083
[4-[(propanoylamino)methyl]phenyl] carbamate
CID 175552226
butane;phenyl carbamate
CID 145076324
(4-ethylphenyl) 2,2-diphenylacetate
CID 1226572
[4-(4-methoxybenzoyl)oxyphenyl] 4-ethylbenzoate
CID 118103231
(4-ethyl-3-methylphenyl) carbamate
CID 3027931
[4-[(4-ethylphenyl)diazenyl]phenyl] acetate
CID 4188126
(4-ethylphenyl) (4-phenylphenyl) carbonate
CID 118690250
(4-ethylphenyl) 4-chlorobenzoate
CID 695931

Frequently Asked Questions

What is the IUPAC name of (4-ethylphenyl) carbamate?
The IUPAC name of (4-ethylphenyl) carbamate (CID 1269945) is (4-ethylphenyl) carbamate.
What is the SMILES notation for (4-ethylphenyl) carbamate?
The canonical SMILES for (4-ethylphenyl) carbamate is CCc1ccc(OC(N)=O)cc1.
What is the InChIKey of (4-ethylphenyl) carbamate?
The InChIKey is WBBJNNIOVSTUQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO2/c1-2-7-3-5-8(6-4-7)12-9(10)11/h3-6H,2H2,1H3,(H2,10,11).
What are the key properties of (4-ethylphenyl) carbamate?
(4-ethylphenyl) carbamate has a molecular weight of 165.19 g/mol, XLogP of 1.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylphenyl) carbamate is sourced from PubChem (CID 1269945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).