N-(2,3-dichlorophenyl)-3-propylpiperidine-3-carboxamide

C15H20Cl2N2O — CID 63132539

IUPACN-(2,3-dichlorophenyl)-3-propylpiperidine-3-carboxamide
SMILESCCCC1(C(=O)Nc2cccc(Cl)c2Cl)CCCNC1
InChIInChI=1S/C15H20Cl2N2O/c1-2-7-15(8-4-9-18-10-15)14(20)19-12-6-3-5-11(16)13(12)17/h3,5-6,18H,2,4,7-10H2,1H3,(H,19,20)
InChIKeyMJNYURAREVQZNO-UHFFFAOYSA-N
MW315.24 g/mol
LogP4.10
Rot. Bonds4

About N-(2,3-dichlorophenyl)-3-propylpiperidine-3-carboxamide

N-(2,3-dichlorophenyl)-3-propylpiperidine-3-carboxamide (PubChem CID 63132539) has the molecular formula C15H20Cl2N2O and a molecular weight of 315.24 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-3-propylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-3-propylpiperidine-3-carboxamide
PubChem CID63132539
Molecular FormulaC15H20Cl2N2O
Molecular Weight315.24 g/mol
Exact Mass314.10
IUPAC NameN-(2,3-dichlorophenyl)-3-propylpiperidine-3-carboxamide
SMILESCCCC1(C(=O)Nc2cccc(Cl)c2Cl)CCCNC1
InChIInChI=1S/C15H20Cl2N2O/c1-2-7-15(8-4-9-18-10-15)14(20)19-12-6-3-5-11(16)13(12)17/h3,5-6,18H,2,4,7-10H2,1H3,(H,19,20)
InChIKeyMJNYURAREVQZNO-UHFFFAOYSA-N
XLogP4.10
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 ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dichlorophenyl)-3-ethylpiperidine-3-carboxamide
CID 55179344
N-(3-chloro-2-pyridinyl)-3-propylpiperidine-3-carboxamide
CID 103094157
N-(4-chloro-2-iodophenyl)-3-propylpiperidine-3-carboxamide
CID 107625392
N-(2,3-dichlorophenyl)-2-propylpyrrolidine-2-carboxamide
CID 106974147
N-(2-ethoxyphenyl)-3-propylpiperidine-3-carboxamide
CID 63132468
2-chloro-6-[(3-ethylpiperidine-3-carbonyl)amino]benzoic acid
CID 63724976
N-(2-nitrophenyl)-3-propylpiperidine-3-carboxamide
CID 63130967
3-propyl-N-(2,4,5-trichlorophenyl)pyrrolidine-3-carboxamide
CID 63140733
3-propyl-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide
CID 63132688
N-(2-chloro-4-iodophenyl)-3-propylpyrrolidine-3-carboxamide
CID 63140297
N-(3-ethynylphenyl)-3-propylpiperidine-3-carboxamide
CID 63132227
N-(4-bromo-2-ethylphenyl)-3-propylpiperidine-3-carboxamide
CID 81287911

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-3-propylpiperidine-3-carboxamide?
The IUPAC name of N-(2,3-dichlorophenyl)-3-propylpiperidine-3-carboxamide (CID 63132539) is N-(2,3-dichlorophenyl)-3-propylpiperidine-3-carboxamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-3-propylpiperidine-3-carboxamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-3-propylpiperidine-3-carboxamide is CCCC1(C(=O)Nc2cccc(Cl)c2Cl)CCCNC1.
What is the InChIKey of N-(2,3-dichlorophenyl)-3-propylpiperidine-3-carboxamide?
The InChIKey is MJNYURAREVQZNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Cl2N2O/c1-2-7-15(8-4-9-18-10-15)14(20)19-12-6-3-5-11(16)13(12)17/h3,5-6,18H,2,4,7-10H2,1H3,(H,19,20).
What are the key properties of N-(2,3-dichlorophenyl)-3-propylpiperidine-3-carboxamide?
N-(2,3-dichlorophenyl)-3-propylpiperidine-3-carboxamide has a molecular weight of 315.24 g/mol, XLogP of 4.10, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-3-propylpiperidine-3-carboxamide is sourced from PubChem (CID 63132539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).