2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-(3,5-dichloro-2-pyridinyl)propanamide

C15H11Cl3N6O — CID 42952316

IUPAC2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-(3,5-dichloro-2-pyridinyl)propanamide
SMILESCC(C(=O)Nc1ncc(Cl)cc1Cl)n1nnc(-c2cccc(Cl)c2)n1
InChIInChI=1S/C15H11Cl3N6O/c1-8(15(25)20-14-12(18)6-11(17)7-19-14)24-22-13(21-23-24)9-3-2-4-10(16)5-9/h2-8H,1H3,(H,19,20,25)
InChIKeyPPDURCUVYLGBSC-UHFFFAOYSA-N
MW397.65 g/mol
LogP3.89
Rot. Bonds4

About 2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-(3,5-dichloro-2-pyridinyl)propanamide

2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-(3,5-dichloro-2-pyridinyl)propanamide (PubChem CID 42952316) has the molecular formula C15H11Cl3N6O and a molecular weight of 397.65 g/mol. Its IUPAC name is 2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-(3,5-dichloro-2-pyridinyl)propanamide.

Molecular Properties

Compound Name2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-(3,5-dichloro-2-pyridinyl)propanamide
PubChem CID42952316
Molecular FormulaC15H11Cl3N6O
Molecular Weight397.65 g/mol
Exact Mass396.01
IUPAC Name2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-(3,5-dichloro-2-pyridinyl)propanamide
SMILESCC(C(=O)Nc1ncc(Cl)cc1Cl)n1nnc(-c2cccc(Cl)c2)n1
InChIInChI=1S/C15H11Cl3N6O/c1-8(15(25)20-14-12(18)6-11(17)7-19-14)24-22-13(21-23-24)9-3-2-4-10(16)5-9/h2-8H,1H3,(H,19,20,25)
InChIKeyPPDURCUVYLGBSC-UHFFFAOYSA-N
XLogP3.89
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.65
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-(3,5-dichloro-2-pyridinyl)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

4-[2-[(2R)-1-[(3,5-dichloro-2-pyridinyl)amino]-1-oxopropan-2-yl]tetrazol-5-yl]benzamide
CID 38983810
(2S)-N-(4-bromophenyl)-2-[5-(3-chlorophenyl)tetrazol-2-yl]propanamide
CID 9355609
(2S)-2-[5-(4-bromophenyl)tetrazol-2-yl]-N-(3-chlorophenyl)propanamide
CID 9355658
3-chloro-N'-[(2S)-2-(5-phenyltetrazol-2-yl)propanoyl]benzohydrazide
CID 95781242
(2S)-N-(3-chlorophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]propanamide
CID 9353578
(2S)-2-[5-(2-bromophenyl)tetrazol-2-yl]-N-(3-chlorophenyl)propanamide
CID 9354256
2-chloro-N-(3,5-dichloro-2-pyridinyl)propanamide
CID 4583439
2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-(3,4-difluorophenyl)propanamide
CID 46583110
2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-(2-methylsulfanylphenyl)propanamide
CID 42986987
2-[5-(4-bromophenyl)tetrazol-2-yl]-N-(5-chloro-2-methylphenyl)propanamide
CID 46624222
N-(2-methylphenyl)-2-(5-phenyltetrazol-2-yl)propanamide
CID 84602572
2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-(3-methyl-1,2-oxazol-5-yl)propanamide
CID 46582904

Frequently Asked Questions

What is the IUPAC name of 2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-(3,5-dichloro-2-pyridinyl)propanamide?
The IUPAC name of 2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-(3,5-dichloro-2-pyridinyl)propanamide (CID 42952316) is 2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-(3,5-dichloro-2-pyridinyl)propanamide.
What is the SMILES notation for 2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-(3,5-dichloro-2-pyridinyl)propanamide?
The canonical SMILES for 2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-(3,5-dichloro-2-pyridinyl)propanamide is CC(C(=O)Nc1ncc(Cl)cc1Cl)n1nnc(-c2cccc(Cl)c2)n1.
What is the InChIKey of 2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-(3,5-dichloro-2-pyridinyl)propanamide?
The InChIKey is PPDURCUVYLGBSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl3N6O/c1-8(15(25)20-14-12(18)6-11(17)7-19-14)24-22-13(21-23-24)9-3-2-4-10(16)5-9/h2-8H,1H3,(H,19,20,25).
What are the key properties of 2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-(3,5-dichloro-2-pyridinyl)propanamide?
2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-(3,5-dichloro-2-pyridinyl)propanamide has a molecular weight of 397.65 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-(3,5-dichloro-2-pyridinyl)propanamide is sourced from PubChem (CID 42952316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).