2-hydroxyethyl N-[(1R)-1-pyridin-2-ylethyl]carbamate

C10H14N2O3 — CID 81406872

IUPAC2-hydroxyethyl N-[(1R)-1-pyridin-2-ylethyl]carbamate
SMILESC[C@@H](NC(=O)OCCO)c1ccccn1
InChIInChI=1S/C10H14N2O3/c1-8(9-4-2-3-5-11-9)12-10(14)15-7-6-13/h2-5,8,13H,6-7H2,1H3,(H,12,14)/t8-/m1/s1
InChIKeyODYQPDCHJQZUPU-MRVPVSSYSA-N
MW210.23 g/mol
LogP0.86
Rot. Bonds4

About 2-hydroxyethyl N-[(1R)-1-pyridin-2-ylethyl]carbamate

2-hydroxyethyl N-[(1R)-1-pyridin-2-ylethyl]carbamate (PubChem CID 81406872) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 2-hydroxyethyl N-[(1R)-1-pyridin-2-ylethyl]carbamate.

Molecular Properties

Compound Name2-hydroxyethyl N-[(1R)-1-pyridin-2-ylethyl]carbamate
PubChem CID81406872
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name2-hydroxyethyl N-[(1R)-1-pyridin-2-ylethyl]carbamate
SMILESC[C@@H](NC(=O)OCCO)c1ccccn1
InChIInChI=1S/C10H14N2O3/c1-8(9-4-2-3-5-11-9)12-10(14)15-7-6-13/h2-5,8,13H,6-7H2,1H3,(H,12,14)/t8-/m1/s1
InChIKeyODYQPDCHJQZUPU-MRVPVSSYSA-N
XLogP0.86
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

phenyl N-[(1S)-1-pyridin-2-ylethyl]carbamate
CID 78980082
N-[(1R)-1-pyridin-2-ylethyl]propanamide
CID 59509331
2-methoxy-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 81407538
3-amino-N-(1-pyridin-2-ylethyl)butanamide;dihydrochloride
CID 119830348
(2S)-2-amino-3-methyl-N-[(1R)-1-pyridin-2-ylethyl]pentanamide
CID 81407362
2-bromo-N-[(1S)-1-pyridin-2-ylethyl]acetamide
CID 81401514
4-amino-N-(1-pyridin-2-ylethyl)pentanamide;dihydrochloride
CID 120564208
(2S)-2-amino-N-(1-pyridin-2-ylethyl)butanamide
CID 79024975
3-chloro-2-methyl-N-[(1S)-1-pyridin-2-ylethyl]propanamide
CID 81402068
ethyl N-(dipyridin-2-ylmethyl)carbamate
CID 162768521
2-(propan-2-ylamino)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 81407440
4-amino-3-methoxy-N-[(1S)-1-pyridin-2-ylethyl]butanamide
CID 103156393

Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl N-[(1R)-1-pyridin-2-ylethyl]carbamate?
The IUPAC name of 2-hydroxyethyl N-[(1R)-1-pyridin-2-ylethyl]carbamate (CID 81406872) is 2-hydroxyethyl N-[(1R)-1-pyridin-2-ylethyl]carbamate.
What is the SMILES notation for 2-hydroxyethyl N-[(1R)-1-pyridin-2-ylethyl]carbamate?
The canonical SMILES for 2-hydroxyethyl N-[(1R)-1-pyridin-2-ylethyl]carbamate is C[C@@H](NC(=O)OCCO)c1ccccn1.
What is the InChIKey of 2-hydroxyethyl N-[(1R)-1-pyridin-2-ylethyl]carbamate?
The InChIKey is ODYQPDCHJQZUPU-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-8(9-4-2-3-5-11-9)12-10(14)15-7-6-13/h2-5,8,13H,6-7H2,1H3,(H,12,14)/t8-/m1/s1.
What are the key properties of 2-hydroxyethyl N-[(1R)-1-pyridin-2-ylethyl]carbamate?
2-hydroxyethyl N-[(1R)-1-pyridin-2-ylethyl]carbamate has a molecular weight of 210.23 g/mol, XLogP of 0.86, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl N-[(1R)-1-pyridin-2-ylethyl]carbamate is sourced from PubChem (CID 81406872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).