3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide

C9H12ClN3O2 — CID 106111210

IUPAC3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide
SMILESCOC(CN)C(=O)Nc1ccc(Cl)cn1
InChIInChI=1S/C9H12ClN3O2/c1-15-7(4-11)9(14)13-8-3-2-6(10)5-12-8/h2-3,5,7H,4,11H2,1H3,(H,12,13,14)
InChIKeyNRPYFBMVMGEYIL-UHFFFAOYSA-N
MW229.67 g/mol
LogP0.65
Rot. Bonds4

About 3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide

3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide (PubChem CID 106111210) has the molecular formula C9H12ClN3O2 and a molecular weight of 229.67 g/mol. Its IUPAC name is 3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide.

Molecular Properties

Compound Name3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide
PubChem CID106111210
Molecular FormulaC9H12ClN3O2
Molecular Weight229.67 g/mol
Exact Mass229.06
IUPAC Name3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide
SMILESCOC(CN)C(=O)Nc1ccc(Cl)cn1
InChIInChI=1S/C9H12ClN3O2/c1-15-7(4-11)9(14)13-8-3-2-6(10)5-12-8/h2-3,5,7H,4,11H2,1H3,(H,12,13,14)
InChIKeyNRPYFBMVMGEYIL-UHFFFAOYSA-N
XLogP0.65
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.67
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(aminomethyl)-N-(5-chloro-2-pyridinyl)-3-methylbutanamide
CID 65226103
(2S)-2-amino-N-(5-chloro-2-pyridinyl)propanamide
CID 61146165
2-amino-N-(5-chloro-2-pyridinyl)butanamide
CID 60779855
5-amino-N-(5-chloro-2-pyridinyl)-2-methylpentanamide
CID 104683574
2-amino-N-(5-chloro-2-pyridinyl)-3-methylbutanamide
CID 76892362
3-amino-N-(5-chloro-2-methylphenyl)-2-methoxypropanamide
CID 106111180
N-(5-chloro-2-pyridinyl)-2-methylsulfonylpropanamide
CID 55756646
N'-(5-chloro-2-pyridinyl)oxamide;hydrochloride
CID 22934756
N-(5-chloro-2-pyridinyl)-2-oxoacetamide;methoxyethane
CID 153335046
methyl N-[4-[[1-[(5-chloro-2-pyridinyl)amino]-1-oxopropan-2-yl]amino]phenyl]carbamate
CID 87033176
2-(aminomethyl)-N-(5-chloro-2-pyridinyl)-2-ethylbutanamide
CID 113308872
N-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide
CID 949027

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide?
The IUPAC name of 3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide (CID 106111210) is 3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide.
What is the SMILES notation for 3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide?
The canonical SMILES for 3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide is COC(CN)C(=O)Nc1ccc(Cl)cn1.
What is the InChIKey of 3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide?
The InChIKey is NRPYFBMVMGEYIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12ClN3O2/c1-15-7(4-11)9(14)13-8-3-2-6(10)5-12-8/h2-3,5,7H,4,11H2,1H3,(H,12,13,14).
What are the key properties of 3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide?
3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide has a molecular weight of 229.67 g/mol, XLogP of 0.65, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide is sourced from PubChem (CID 106111210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).