2-hydroxyethyl N-(3-ethylpentan-3-yl)carbamate

C10H21NO3 — CID 79349873

IUPAC2-hydroxyethyl N-(3-ethylpentan-3-yl)carbamate
SMILESCCC(CC)(CC)NC(=O)OCCO
InChIInChI=1S/C10H21NO3/c1-4-10(5-2,6-3)11-9(13)14-8-7-12/h12H,4-8H2,1-3H3,(H,11,13)
InChIKeyDWUMQPOJHPUSJU-UHFFFAOYSA-N
MW203.28 g/mol
LogP1.67
Rot. Bonds6

About 2-hydroxyethyl N-(3-ethylpentan-3-yl)carbamate

2-hydroxyethyl N-(3-ethylpentan-3-yl)carbamate (PubChem CID 79349873) has the molecular formula C10H21NO3 and a molecular weight of 203.28 g/mol. Its IUPAC name is 2-hydroxyethyl N-(3-ethylpentan-3-yl)carbamate.

Molecular Properties

Compound Name2-hydroxyethyl N-(3-ethylpentan-3-yl)carbamate
PubChem CID79349873
Molecular FormulaC10H21NO3
Molecular Weight203.28 g/mol
Exact Mass203.15
IUPAC Name2-hydroxyethyl N-(3-ethylpentan-3-yl)carbamate
SMILESCCC(CC)(CC)NC(=O)OCCO
InChIInChI=1S/C10H21NO3/c1-4-10(5-2,6-3)11-9(13)14-8-7-12/h12H,4-8H2,1-3H3,(H,11,13)
InChIKeyDWUMQPOJHPUSJU-UHFFFAOYSA-N
XLogP1.67
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxyethyl N-propan-2-ylcarbamate
CID 71382722
2-hydroxyethyl N-propylcarbamate
CID 15560805
2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl N-tert-butylcarbamate
CID 129320050
tert-butyl N-(3-ethyl-1-hydroxypentan-3-yl)carbamate
CID 131125544
2-(tert-butylcarbamoyloxy)ethyl N-tert-butylcarbamate
CID 176596941
tert-butyl N-[3-(hydroxymethyl)pentan-3-yl]carbamate
CID 62517962
2-hydroxyethyl N-heptylcarbamate
CID 124705283
2-hydroxyethyl N-[(2-hydroxyethoxycarbonylcarbamoylamino)carbamoyl]carbamate
CID 101055685
4-(2-carboxyethyl)-4-(docosoxycarbonylamino)heptanedioic acid
CID 44572434
2-hydroxyethyl N-(4-propylcyclohexyl)carbamate
CID 79349163
4-(2-carboxyethyl)-4-(heptadecoxycarbonylamino)heptanedioic acid
CID 71593431
methyl 2-(2-hydroxyethoxycarbonylamino)-3-methylpentanoate
CID 79345601

Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl N-(3-ethylpentan-3-yl)carbamate?
The IUPAC name of 2-hydroxyethyl N-(3-ethylpentan-3-yl)carbamate (CID 79349873) is 2-hydroxyethyl N-(3-ethylpentan-3-yl)carbamate.
What is the SMILES notation for 2-hydroxyethyl N-(3-ethylpentan-3-yl)carbamate?
The canonical SMILES for 2-hydroxyethyl N-(3-ethylpentan-3-yl)carbamate is CCC(CC)(CC)NC(=O)OCCO.
What is the InChIKey of 2-hydroxyethyl N-(3-ethylpentan-3-yl)carbamate?
The InChIKey is DWUMQPOJHPUSJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3/c1-4-10(5-2,6-3)11-9(13)14-8-7-12/h12H,4-8H2,1-3H3,(H,11,13).
What are the key properties of 2-hydroxyethyl N-(3-ethylpentan-3-yl)carbamate?
2-hydroxyethyl N-(3-ethylpentan-3-yl)carbamate has a molecular weight of 203.28 g/mol, XLogP of 1.67, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl N-(3-ethylpentan-3-yl)carbamate is sourced from PubChem (CID 79349873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).