(2R)-N-(5-bromo-2-oxo-1H-pyridin-3-yl)-2-(cyclopropylmethoxy)propanamide

C12H15BrN2O3 — CID 95149293

IUPAC(2R)-N-(5-bromo-2-oxo-1H-pyridin-3-yl)-2-(cyclopropylmethoxy)propanamide
SMILESC[C@@H](OCC1CC1)C(=O)Nc1cc(Br)c[nH]c1=O
InChIInChI=1S/C12H15BrN2O3/c1-7(18-6-8-2-3-8)11(16)15-10-4-9(13)5-14-12(10)17/h4-5,7-8H,2-3,6H2,1H3,(H,14,17)(H,15,16)/t7-/m1/s1
InChIKeyUHAYJCIZAOZESY-SSDOTTSWSA-N
MW315.17 g/mol
LogP1.89
Rot. Bonds5

About (2R)-N-(5-bromo-2-oxo-1H-pyridin-3-yl)-2-(cyclopropylmethoxy)propanamide

(2R)-N-(5-bromo-2-oxo-1H-pyridin-3-yl)-2-(cyclopropylmethoxy)propanamide (PubChem CID 95149293) has the molecular formula C12H15BrN2O3 and a molecular weight of 315.17 g/mol. Its IUPAC name is (2R)-N-(5-bromo-2-oxo-1H-pyridin-3-yl)-2-(cyclopropylmethoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-(5-bromo-2-oxo-1H-pyridin-3-yl)-2-(cyclopropylmethoxy)propanamide
PubChem CID95149293
Molecular FormulaC12H15BrN2O3
Molecular Weight315.17 g/mol
Exact Mass314.03
IUPAC Name(2R)-N-(5-bromo-2-oxo-1H-pyridin-3-yl)-2-(cyclopropylmethoxy)propanamide
SMILESC[C@@H](OCC1CC1)C(=O)Nc1cc(Br)c[nH]c1=O
InChIInChI=1S/C12H15BrN2O3/c1-7(18-6-8-2-3-8)11(16)15-10-4-9(13)5-14-12(10)17/h4-5,7-8H,2-3,6H2,1H3,(H,14,17)(H,15,16)/t7-/m1/s1
InChIKeyUHAYJCIZAOZESY-SSDOTTSWSA-N
XLogP1.89
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.17
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-(5-bromo-2-oxo-1H-pyridin-3-yl)propanamide
CID 119862463
N-(5-bromo-2-oxo-1H-pyridin-3-yl)-2-cyclohexylacetamide
CID 84559169
(2S)-2-[[(2S)-oxolan-2-yl]methoxy]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide
CID 95977169
2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide
CID 48530161
2-(cyclopropylmethoxy)-N-(2-hydroxy-5-nitrophenyl)propanamide
CID 102560816
N-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide
CID 43188643
2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide
CID 86846916
N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide
CID 66323873
N-(4-amino-2-chlorophenyl)-2-(cyclohexylmethoxy)propanamide
CID 62382552
N-[2-chloro-5-(propanoylamino)phenyl]-2-(cyclopropylmethoxy)propanamide
CID 48521300
(2R)-2-(cyclopropylmethoxy)-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]propanamide
CID 95977136
N-(2-amino-4-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide
CID 66321735

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(5-bromo-2-oxo-1H-pyridin-3-yl)-2-(cyclopropylmethoxy)propanamide?
The IUPAC name of (2R)-N-(5-bromo-2-oxo-1H-pyridin-3-yl)-2-(cyclopropylmethoxy)propanamide (CID 95149293) is (2R)-N-(5-bromo-2-oxo-1H-pyridin-3-yl)-2-(cyclopropylmethoxy)propanamide.
What is the SMILES notation for (2R)-N-(5-bromo-2-oxo-1H-pyridin-3-yl)-2-(cyclopropylmethoxy)propanamide?
The canonical SMILES for (2R)-N-(5-bromo-2-oxo-1H-pyridin-3-yl)-2-(cyclopropylmethoxy)propanamide is C[C@@H](OCC1CC1)C(=O)Nc1cc(Br)c[nH]c1=O.
What is the InChIKey of (2R)-N-(5-bromo-2-oxo-1H-pyridin-3-yl)-2-(cyclopropylmethoxy)propanamide?
The InChIKey is UHAYJCIZAOZESY-SSDOTTSWSA-N. The full InChI is InChI=1S/C12H15BrN2O3/c1-7(18-6-8-2-3-8)11(16)15-10-4-9(13)5-14-12(10)17/h4-5,7-8H,2-3,6H2,1H3,(H,14,17)(H,15,16)/t7-/m1/s1.
What are the key properties of (2R)-N-(5-bromo-2-oxo-1H-pyridin-3-yl)-2-(cyclopropylmethoxy)propanamide?
(2R)-N-(5-bromo-2-oxo-1H-pyridin-3-yl)-2-(cyclopropylmethoxy)propanamide has a molecular weight of 315.17 g/mol, XLogP of 1.89, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(5-bromo-2-oxo-1H-pyridin-3-yl)-2-(cyclopropylmethoxy)propanamide is sourced from PubChem (CID 95149293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).