2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate

C11H16N2O3 — CID 82744779

IUPAC2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate
SMILESCCc1cccnc1CNC(=O)OCCO
InChIInChI=1S/C11H16N2O3/c1-2-9-4-3-5-12-10(9)8-13-11(15)16-7-6-14/h3-5,14H,2,6-8H2,1H3,(H,13,15)
InChIKeyMYQYMIPWKXQARH-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.86
Rot. Bonds5

About 2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate

2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate (PubChem CID 82744779) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate.

Molecular Properties

Compound Name2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate
PubChem CID82744779
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate
SMILESCCc1cccnc1CNC(=O)OCCO
InChIInChI=1S/C11H16N2O3/c1-2-9-4-3-5-12-10(9)8-13-11(15)16-7-6-14/h3-5,14H,2,6-8H2,1H3,(H,13,15)
InChIKeyMYQYMIPWKXQARH-UHFFFAOYSA-N
XLogP0.86
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-3-methoxypropanamide
CID 82738332
3-amino-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide
CID 104742770
2-[(3-ethyl-2-pyridinyl)methylamino]ethanol
CID 82738095
3-amino-N-[(3-ethyl-2-pyridinyl)methyl]butanamide
CID 82738689
2,6-dichloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-3-carboxamide
CID 106994204
2-(4-aminophenoxy)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide
CID 82733539
2-cyano-N-[(3-ethyl-2-pyridinyl)methyl]propanamide
CID 82737778
N-[(3-ethyl-2-pyridinyl)methyl]-2H-triazole-4-carboxamide
CID 82748926
2-hydroxyethyl N-(pyridazin-3-ylmethyl)carbamate
CID 106897873
1-cyclopropyl-3-[(3-ethyl-2-pyridinyl)methyl]urea
CID 116657152
tert-butyl N-[(2-ethyl-3-pyridinyl)methyl]carbamate
CID 118168082
N-[(3-ethyl-2-pyridinyl)methyl]-4-(methylamino)benzamide
CID 82743343

Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate?
The IUPAC name of 2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate (CID 82744779) is 2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate.
What is the SMILES notation for 2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate?
The canonical SMILES for 2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate is CCc1cccnc1CNC(=O)OCCO.
What is the InChIKey of 2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate?
The InChIKey is MYQYMIPWKXQARH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-2-9-4-3-5-12-10(9)8-13-11(15)16-7-6-14/h3-5,14H,2,6-8H2,1H3,(H,13,15).
What are the key properties of 2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate?
2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate has a molecular weight of 224.26 g/mol, XLogP of 0.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate is sourced from PubChem (CID 82744779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).