N-(2,6-dichlorophenyl)-3-[piperidin-4-yl(propyl)amino]propanamide

C17H25Cl2N3O — CID 119932799

IUPACN-(2,6-dichlorophenyl)-3-[piperidin-4-yl(propyl)amino]propanamide
SMILESCCCN(CCC(=O)Nc1c(Cl)cccc1Cl)C1CCNCC1
InChIInChI=1S/C17H25Cl2N3O/c1-2-11-22(13-6-9-20-10-7-13)12-8-16(23)21-17-14(18)4-3-5-15(17)19/h3-5,13,20H,2,6-12H2,1H3,(H,21,23)
InChIKeyQFULYPMTGHYALE-UHFFFAOYSA-N
MW358.31 g/mol
LogP3.79
Rot. Bonds7

About N-(2,6-dichlorophenyl)-3-[piperidin-4-yl(propyl)amino]propanamide

N-(2,6-dichlorophenyl)-3-[piperidin-4-yl(propyl)amino]propanamide (PubChem CID 119932799) has the molecular formula C17H25Cl2N3O and a molecular weight of 358.31 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-3-[piperidin-4-yl(propyl)amino]propanamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-3-[piperidin-4-yl(propyl)amino]propanamide
PubChem CID119932799
Molecular FormulaC17H25Cl2N3O
Molecular Weight358.31 g/mol
Exact Mass357.14
IUPAC NameN-(2,6-dichlorophenyl)-3-[piperidin-4-yl(propyl)amino]propanamide
SMILESCCCN(CCC(=O)Nc1c(Cl)cccc1Cl)C1CCNCC1
InChIInChI=1S/C17H25Cl2N3O/c1-2-11-22(13-6-9-20-10-7-13)12-8-16(23)21-17-14(18)4-3-5-15(17)19/h3-5,13,20H,2,6-12H2,1H3,(H,21,23)
InChIKeyQFULYPMTGHYALE-UHFFFAOYSA-N
XLogP3.79
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.31
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,6-dichlorophenyl)-3-[propyl(pyrrolidin-3-yl)amino]propanamide
CID 119921476
2-[piperidin-4-yl(propyl)amino]-N-(2,4,6-trichlorophenyl)acetamide
CID 119932936
2-[cyclopropyl-[3-(2,6-dichloroanilino)-3-oxopropyl]amino]acetic acid
CID 60834197
3-[azetidin-3-yl(methyl)amino]-N-(2,6-dichlorophenyl)propanamide
CID 66185509
N-(2,6-dichlorophenyl)-3-piperidin-4-ylpropanamide
CID 65468978
N-(2-amino-4,6-dichlorophenyl)-3-[cyclopropyl(propyl)amino]propanamide
CID 43269987
N-[(2,3-dichlorophenyl)methyl]-N-propylpiperidin-4-amine
CID 58624352
methyl 3-[piperidin-4-yl(propyl)amino]propanoate
CID 60806658
N-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride
CID 119929877
3-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-(2,6-dichlorophenyl)propanamide
CID 34982405
N-(3-chloro-4-fluorophenyl)-2-[piperidin-4-yl(propyl)amino]acetamide
CID 119933053
N,N'-bis(2,6-dichlorophenyl)butanediamide
CID 1010966

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-3-[piperidin-4-yl(propyl)amino]propanamide?
The IUPAC name of N-(2,6-dichlorophenyl)-3-[piperidin-4-yl(propyl)amino]propanamide (CID 119932799) is N-(2,6-dichlorophenyl)-3-[piperidin-4-yl(propyl)amino]propanamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-3-[piperidin-4-yl(propyl)amino]propanamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-3-[piperidin-4-yl(propyl)amino]propanamide is CCCN(CCC(=O)Nc1c(Cl)cccc1Cl)C1CCNCC1.
What is the InChIKey of N-(2,6-dichlorophenyl)-3-[piperidin-4-yl(propyl)amino]propanamide?
The InChIKey is QFULYPMTGHYALE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25Cl2N3O/c1-2-11-22(13-6-9-20-10-7-13)12-8-16(23)21-17-14(18)4-3-5-15(17)19/h3-5,13,20H,2,6-12H2,1H3,(H,21,23).
What are the key properties of N-(2,6-dichlorophenyl)-3-[piperidin-4-yl(propyl)amino]propanamide?
N-(2,6-dichlorophenyl)-3-[piperidin-4-yl(propyl)amino]propanamide has a molecular weight of 358.31 g/mol, XLogP of 3.79, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-3-[piperidin-4-yl(propyl)amino]propanamide is sourced from PubChem (CID 119932799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).