1-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]piperidine-2-carboxamide

C16H18Cl2N2O2 — CID 75373592

IUPAC1-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]piperidine-2-carboxamide
SMILESNC(=O)C1CCCCN1C(=O)C1CC1c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C16H18Cl2N2O2/c17-10-5-9(6-11(18)7-10)12-8-13(12)16(22)20-4-2-1-3-14(20)15(19)21/h5-7,12-14H,1-4,8H2,(H2,19,21)
InChIKeyRUCOSHWPLDJDDG-UHFFFAOYSA-N
MW341.24 g/mol
LogP2.96
Rot. Bonds3

About 1-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]piperidine-2-carboxamide

1-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]piperidine-2-carboxamide (PubChem CID 75373592) has the molecular formula C16H18Cl2N2O2 and a molecular weight of 341.24 g/mol. Its IUPAC name is 1-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name1-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]piperidine-2-carboxamide
PubChem CID75373592
Molecular FormulaC16H18Cl2N2O2
Molecular Weight341.24 g/mol
Exact Mass340.07
IUPAC Name1-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]piperidine-2-carboxamide
SMILESNC(=O)C1CCCCN1C(=O)C1CC1c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C16H18Cl2N2O2/c17-10-5-9(6-11(18)7-10)12-8-13(12)16(22)20-4-2-1-3-14(20)15(19)21/h5-7,12-14H,1-4,8H2,(H2,19,21)
InChIKeyRUCOSHWPLDJDDG-UHFFFAOYSA-N
XLogP2.96
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.24
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(1-aminoethyl)piperidin-1-yl]-[2-(3,5-dichlorophenyl)cyclopropyl]methanone;hydrochloride
CID 119434819
1-[2-(3,4-difluorophenyl)cyclopropanecarbonyl]piperidine-2-carboxylic acid
CID 91647027
4-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]morpholine-3-carboxylic acid
CID 119217087
(2R)-1-[(1S,2R)-2-(3,4-difluorophenyl)cyclopropanecarbonyl]piperidine-2-carboxylic acid
CID 124572542
1-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]-6-methylpiperidine-3-carboxylic acid
CID 122113476
(3R)-1-[(1S,2S)-2-(3,5-dichlorophenyl)cyclopropanecarbonyl]pyrrolidine-3-carboxylic acid
CID 125134395
[(2S)-2-[(1S)-1-aminoethyl]piperidin-1-yl]-[(1S,2R)-2-(3-chlorophenyl)cyclopropyl]methanone
CID 125151836
(2R)-1-[(1R,2S)-2-(4-fluorophenyl)cyclopropanecarbonyl]piperidine-2-carboxylic acid
CID 124577107
[(3S)-3-(aminomethyl)pyrrolidin-1-yl]-[(1S,2S)-2-(3,5-dichlorophenyl)cyclopropyl]methanone
CID 124865626
(2S)-1-[(1S,2R)-2-(3-methylphenyl)cyclopropanecarbonyl]piperidine-2-carboxylic acid
CID 129435444
(2R)-1-[(1S,2R)-2-(3-methylphenyl)cyclopropanecarbonyl]piperidine-2-carboxylic acid
CID 99849301
1-[2-(3,4-difluorophenyl)cyclopropanecarbonyl]pyrrolidine-2-carboxylic acid
CID 119356871

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]piperidine-2-carboxamide?
The IUPAC name of 1-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]piperidine-2-carboxamide (CID 75373592) is 1-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]piperidine-2-carboxamide.
What is the SMILES notation for 1-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]piperidine-2-carboxamide?
The canonical SMILES for 1-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]piperidine-2-carboxamide is NC(=O)C1CCCCN1C(=O)C1CC1c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 1-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]piperidine-2-carboxamide?
The InChIKey is RUCOSHWPLDJDDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18Cl2N2O2/c17-10-5-9(6-11(18)7-10)12-8-13(12)16(22)20-4-2-1-3-14(20)15(19)21/h5-7,12-14H,1-4,8H2,(H2,19,21).
What are the key properties of 1-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]piperidine-2-carboxamide?
1-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]piperidine-2-carboxamide has a molecular weight of 341.24 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3,5-dichlorophenyl)cyclopropanecarbonyl]piperidine-2-carboxamide is sourced from PubChem (CID 75373592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).