N-(2-chloro-6-methylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide

C19H20ClN3O — CID 68872390

IUPACN-(2-chloro-6-methylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide
SMILESCc1cccc(Cl)c1NC(=O)CN1CC=C(c2ccccn2)CC1
InChIInChI=1S/C19H20ClN3O/c1-14-5-4-6-16(20)19(14)22-18(24)13-23-11-8-15(9-12-23)17-7-2-3-10-21-17/h2-8,10H,9,11-13H2,1H3,(H,22,24)
InChIKeyRTRDKMRRKXGIOV-UHFFFAOYSA-N
MW341.84 g/mol
LogP3.77
Rot. Bonds4

About N-(2-chloro-6-methylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide

N-(2-chloro-6-methylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide (PubChem CID 68872390) has the molecular formula C19H20ClN3O and a molecular weight of 341.84 g/mol. Its IUPAC name is N-(2-chloro-6-methylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-chloro-6-methylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide
PubChem CID68872390
Molecular FormulaC19H20ClN3O
Molecular Weight341.84 g/mol
Exact Mass341.13
IUPAC NameN-(2-chloro-6-methylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide
SMILESCc1cccc(Cl)c1NC(=O)CN1CC=C(c2ccccn2)CC1
InChIInChI=1S/C19H20ClN3O/c1-14-5-4-6-16(20)19(14)22-18(24)13-23-11-8-15(9-12-23)17-7-2-3-10-21-17/h2-8,10H,9,11-13H2,1H3,(H,22,24)
InChIKeyRTRDKMRRKXGIOV-UHFFFAOYSA-N
XLogP3.77
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.84
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide
CID 68874135
N-(2-chloro-6-methylphenyl)-2-pyrrolidin-1-ylacetamide;hydrochloride
CID 24832627
N-(2,6-dichlorophenyl)-2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]acetamide
CID 46666961
N-[(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalene-1-carboxamide
CID 68874752
2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]-N-(2-methylphenyl)acetamide
CID 18125013
N-(2-chloro-4,6-dimethylphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 8545961
3-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)propan-1-ol
CID 21357383
2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2,6-dimethylphenyl)acetamide
CID 6458103
2-[4-[2-(2-chlorophenoxy)acetyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)acetamide
CID 9021527
1-(2-chloro-6-methylphenyl)-3-(pyridin-2-ylmethyl)urea
CID 134086734
2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]-N-quinolin-5-ylacetamide
CID 24682364
[2-(2-chloro-6-methylanilino)-2-oxoethyl]-[2-(2,6-dimethylanilino)-2-oxoethyl]-dimethylazanium
CID 20801

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-6-methylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide?
The IUPAC name of N-(2-chloro-6-methylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide (CID 68872390) is N-(2-chloro-6-methylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide.
What is the SMILES notation for N-(2-chloro-6-methylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide?
The canonical SMILES for N-(2-chloro-6-methylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide is Cc1cccc(Cl)c1NC(=O)CN1CC=C(c2ccccn2)CC1.
What is the InChIKey of N-(2-chloro-6-methylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide?
The InChIKey is RTRDKMRRKXGIOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN3O/c1-14-5-4-6-16(20)19(14)22-18(24)13-23-11-8-15(9-12-23)17-7-2-3-10-21-17/h2-8,10H,9,11-13H2,1H3,(H,22,24).
What are the key properties of N-(2-chloro-6-methylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide?
N-(2-chloro-6-methylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide has a molecular weight of 341.84 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-6-methylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide is sourced from PubChem (CID 68872390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).