N-(2,6-dichloro-3-methylphenyl)-3-piperidin-4-ylpropanamide

C15H20Cl2N2O — CID 62211874

IUPACN-(2,6-dichloro-3-methylphenyl)-3-piperidin-4-ylpropanamide
SMILESCc1ccc(Cl)c(NC(=O)CCC2CCNCC2)c1Cl
InChIInChI=1S/C15H20Cl2N2O/c1-10-2-4-12(16)15(14(10)17)19-13(20)5-3-11-6-8-18-9-7-11/h2,4,11,18H,3,5-9H2,1H3,(H,19,20)
InChIKeyZUVDMRKDZOMLJN-UHFFFAOYSA-N
MW315.24 g/mol
LogP4.02
Rot. Bonds4

About N-(2,6-dichloro-3-methylphenyl)-3-piperidin-4-ylpropanamide

N-(2,6-dichloro-3-methylphenyl)-3-piperidin-4-ylpropanamide (PubChem CID 62211874) has the molecular formula C15H20Cl2N2O and a molecular weight of 315.24 g/mol. Its IUPAC name is N-(2,6-dichloro-3-methylphenyl)-3-piperidin-4-ylpropanamide.

Molecular Properties

Compound NameN-(2,6-dichloro-3-methylphenyl)-3-piperidin-4-ylpropanamide
PubChem CID62211874
Molecular FormulaC15H20Cl2N2O
Molecular Weight315.24 g/mol
Exact Mass314.10
IUPAC NameN-(2,6-dichloro-3-methylphenyl)-3-piperidin-4-ylpropanamide
SMILESCc1ccc(Cl)c(NC(=O)CCC2CCNCC2)c1Cl
InChIInChI=1S/C15H20Cl2N2O/c1-10-2-4-12(16)15(14(10)17)19-13(20)5-3-11-6-8-18-9-7-11/h2,4,11,18H,3,5-9H2,1H3,(H,19,20)
InChIKeyZUVDMRKDZOMLJN-UHFFFAOYSA-N
XLogP4.02
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.24
LogP ≤ 54.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-dichlorophenyl)-3-piperidin-4-ylpropanamide
CID 65468978
2-(azetidin-3-yl)-N-(2,6-dichloro-3-methylphenyl)acetamide
CID 64618728
N-(2-methylphenyl)-3-piperidin-4-ylpropanamide
CID 62210327
N-(2,4-dichlorophenyl)-3-piperidin-4-ylpropanamide
CID 62210490
4-chloro-3-(3-piperidin-4-ylpropanoylamino)benzoic acid
CID 62210412
N-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-4-carboxamide
CID 63127324
6-(2,6-dichloro-3-methylanilino)-6-oxohexanoic acid
CID 43529433
N-(3,5-dichloro-4-hydroxyphenyl)-3-piperidin-4-ylpropanamide
CID 107680294
3-(2,6-dichloro-3-methylanilino)-3-oxopropanoic acid
CID 62231070
5-bromo-N-(2,6-dichloro-3-methylphenyl)pentanamide
CID 107907179
2-(tert-butylamino)-N-(2,6-dichloro-3-methylphenyl)acetamide
CID 27149947
N-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide
CID 114427824

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichloro-3-methylphenyl)-3-piperidin-4-ylpropanamide?
The IUPAC name of N-(2,6-dichloro-3-methylphenyl)-3-piperidin-4-ylpropanamide (CID 62211874) is N-(2,6-dichloro-3-methylphenyl)-3-piperidin-4-ylpropanamide.
What is the SMILES notation for N-(2,6-dichloro-3-methylphenyl)-3-piperidin-4-ylpropanamide?
The canonical SMILES for N-(2,6-dichloro-3-methylphenyl)-3-piperidin-4-ylpropanamide is Cc1ccc(Cl)c(NC(=O)CCC2CCNCC2)c1Cl.
What is the InChIKey of N-(2,6-dichloro-3-methylphenyl)-3-piperidin-4-ylpropanamide?
The InChIKey is ZUVDMRKDZOMLJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Cl2N2O/c1-10-2-4-12(16)15(14(10)17)19-13(20)5-3-11-6-8-18-9-7-11/h2,4,11,18H,3,5-9H2,1H3,(H,19,20).
What are the key properties of N-(2,6-dichloro-3-methylphenyl)-3-piperidin-4-ylpropanamide?
N-(2,6-dichloro-3-methylphenyl)-3-piperidin-4-ylpropanamide has a molecular weight of 315.24 g/mol, XLogP of 4.02, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichloro-3-methylphenyl)-3-piperidin-4-ylpropanamide is sourced from PubChem (CID 62211874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).