N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride

C19H15Cl3N2O2 — CID 44641711

IUPACN-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride
SMILESCc1cccc(C(=O)Nc2ccc(Oc3ccc(Cl)cc3Cl)nc2)c1.Cl
InChIInChI=1S/C19H14Cl2N2O2.ClH/c1-12-3-2-4-13(9-12)19(24)23-15-6-8-18(22-11-15)25-17-7-5-14(20)10-16(17)21;/h2-11H,1H3,(H,23,24);1H
InChIKeyCRIOALAZZSZTIQ-UHFFFAOYSA-N
MW409.70 g/mol
LogP6.16
Rot. Bonds4

About N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride

N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride (PubChem CID 44641711) has the molecular formula C19H15Cl3N2O2 and a molecular weight of 409.70 g/mol. Its IUPAC name is N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride.

Molecular Properties

Compound NameN-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride
PubChem CID44641711
Molecular FormulaC19H15Cl3N2O2
Molecular Weight409.70 g/mol
Exact Mass408.02
IUPAC NameN-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride
SMILESCc1cccc(C(=O)Nc2ccc(Oc3ccc(Cl)cc3Cl)nc2)c1.Cl
InChIInChI=1S/C19H14Cl2N2O2.ClH/c1-12-3-2-4-13(9-12)19(24)23-15-6-8-18(22-11-15)25-17-7-5-14(20)10-16(17)21;/h2-11H,1H3,(H,23,24);1H
InChIKeyCRIOALAZZSZTIQ-UHFFFAOYSA-N
XLogP6.16
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500409.70
LogP ≤ 56.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-4-methylbenzamide
CID 40541033
N-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide
CID 18419514
3-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-(3-methylphenyl)benzamide
CID 11839533
N-[6-(3,5-dichloroanilino)-3-pyridinyl]-3-methylbenzamide
CID 113022321
4-chloro-N-[3-chloro-4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-2-carboxamide
CID 73058486
N-(6-chloro-5-methyl-3-pyridinyl)-3-methylbenzamide
CID 103730447
ethyl 2-[3-chloro-4-[[5-[[3-fluoro-4-(trifluoromethyl)benzoyl]amino]-2-pyridinyl]oxy]phenyl]acetate
CID 70985167
N-[3-chloro-4-[(5-chloro-2-pyridinyl)oxy]phenyl]-5-methylfuran-2-carboxamide
CID 73058458
N-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide
CID 42691206
3,4-dichloro-N-[6-[(1-ethoxy-3H-inden-4-yl)oxy]-3-pyridinyl]benzamide
CID 18673945
5-chloro-2-(2,4-dichlorophenoxy)pyridine
CID 66232986
5-chloro-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]furan-2-carboxamide
CID 55675140

Frequently Asked Questions

What is the IUPAC name of N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride?
The IUPAC name of N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride (CID 44641711) is N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride.
What is the SMILES notation for N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride?
The canonical SMILES for N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride is Cc1cccc(C(=O)Nc2ccc(Oc3ccc(Cl)cc3Cl)nc2)c1.Cl.
What is the InChIKey of N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride?
The InChIKey is CRIOALAZZSZTIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14Cl2N2O2.ClH/c1-12-3-2-4-13(9-12)19(24)23-15-6-8-18(22-11-15)25-17-7-5-14(20)10-16(17)21;/h2-11H,1H3,(H,23,24);1H.
What are the key properties of N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride?
N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride has a molecular weight of 409.70 g/mol, XLogP of 6.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride is sourced from PubChem (CID 44641711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).