N-(5-chloro-2-pyridinyl)-2-(4-cyanophenoxy)propanamide

C15H12ClN3O2 — CID 51140376

IUPACN-(5-chloro-2-pyridinyl)-2-(4-cyanophenoxy)propanamide
SMILESCC(Oc1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)cn1
InChIInChI=1S/C15H12ClN3O2/c1-10(21-13-5-2-11(8-17)3-6-13)15(20)19-14-7-4-12(16)9-18-14/h2-7,9-10H,1H3,(H,18,19,20)
InChIKeySZTBCTCMDXQYHD-UHFFFAOYSA-N
MW301.73 g/mol
LogP3.01
Rot. Bonds4

About N-(5-chloro-2-pyridinyl)-2-(4-cyanophenoxy)propanamide

N-(5-chloro-2-pyridinyl)-2-(4-cyanophenoxy)propanamide (PubChem CID 51140376) has the molecular formula C15H12ClN3O2 and a molecular weight of 301.73 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-2-(4-cyanophenoxy)propanamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-2-(4-cyanophenoxy)propanamide
PubChem CID51140376
Molecular FormulaC15H12ClN3O2
Molecular Weight301.73 g/mol
Exact Mass301.06
IUPAC NameN-(5-chloro-2-pyridinyl)-2-(4-cyanophenoxy)propanamide
SMILESCC(Oc1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)cn1
InChIInChI=1S/C15H12ClN3O2/c1-10(21-13-5-2-11(8-17)3-6-13)15(20)19-14-7-4-12(16)9-18-14/h2-7,9-10H,1H3,(H,18,19,20)
InChIKeySZTBCTCMDXQYHD-UHFFFAOYSA-N
XLogP3.01
TPSA75.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.73
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(5-chloro-2-pyridinyl)-2-(4-cyanophenoxy)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-2-(4-cyanophenoxy)-N-(5-methyl-2-pyridinyl)propanamide
CID 40953055
(2R)-N-(5-chloro-2-pyridinyl)-2-(4-fluorophenoxy)propanamide
CID 42561555
(2S)-N-(5-chloro-2-pyridinyl)-2-(4-cyano-2-methoxyphenoxy)propanamide
CID 51545374
N-(5-chloro-2-fluorophenyl)-2-(4-cyanophenoxy)propanamide
CID 16548334
(2R)-2-(4-cyanophenoxy)-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide
CID 94796234
(2S)-2-[4-(4-cyanophenyl)phenoxy]-N-(3,5-dichlorophenyl)propanamide
CID 7670178
(2R)-2-(4-cyanophenoxy)-N-(1-methylpyrazol-3-yl)propanamide
CID 25438347
(4-cyanophenyl) (2R)-2-(4-chlorophenoxy)propanoate
CID 7913075
(2S)-N-(4-cyanophenyl)-2-(3,4-dichlorophenoxy)propanamide
CID 7433052
N-(5-chloro-2-pyridinyl)-2-(2,4-dichlorophenoxy)propanamide
CID 2939243
2-(4-chlorophenoxy)-N-pyridin-2-ylpropanamide
CID 51193962
(2R)-2-(4-cyanophenoxy)-N-(2,3,4-trifluorophenyl)propanamide
CID 7503342

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-2-(4-cyanophenoxy)propanamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-2-(4-cyanophenoxy)propanamide (CID 51140376) is N-(5-chloro-2-pyridinyl)-2-(4-cyanophenoxy)propanamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-2-(4-cyanophenoxy)propanamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-2-(4-cyanophenoxy)propanamide is CC(Oc1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)cn1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-2-(4-cyanophenoxy)propanamide?
The InChIKey is SZTBCTCMDXQYHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O2/c1-10(21-13-5-2-11(8-17)3-6-13)15(20)19-14-7-4-12(16)9-18-14/h2-7,9-10H,1H3,(H,18,19,20).
What are the key properties of N-(5-chloro-2-pyridinyl)-2-(4-cyanophenoxy)propanamide?
N-(5-chloro-2-pyridinyl)-2-(4-cyanophenoxy)propanamide has a molecular weight of 301.73 g/mol, XLogP of 3.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-2-(4-cyanophenoxy)propanamide is sourced from PubChem (CID 51140376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).