4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide

C16H20ClFN2O — CID 106626825

IUPAC4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide
SMILESO=C(c1ccc(Cl)cc1F)N(CC1CCCCN1)C1CC1
InChIInChI=1S/C16H20ClFN2O/c17-11-4-7-14(15(18)9-11)16(21)20(13-5-6-13)10-12-3-1-2-8-19-12/h4,7,9,12-13,19H,1-3,5-6,8,10H2
InChIKeyMHUNFSLQZYALHH-UHFFFAOYSA-N
MW310.80 g/mol
LogP3.23
Rot. Bonds4

About 4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide

4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide (PubChem CID 106626825) has the molecular formula C16H20ClFN2O and a molecular weight of 310.80 g/mol. Its IUPAC name is 4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide
PubChem CID106626825
Molecular FormulaC16H20ClFN2O
Molecular Weight310.80 g/mol
Exact Mass310.12
IUPAC Name4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide
SMILESO=C(c1ccc(Cl)cc1F)N(CC1CCCCN1)C1CC1
InChIInChI=1S/C16H20ClFN2O/c17-11-4-7-14(15(18)9-11)16(21)20(13-5-6-13)10-12-3-1-2-8-19-12/h4,7,9,12-13,19H,1-3,5-6,8,10H2
InChIKeyMHUNFSLQZYALHH-UHFFFAOYSA-N
XLogP3.23
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.80
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopropyl-2,5-dihydroxy-N-(piperidin-2-ylmethyl)benzamide
CID 107725344
2-chloro-N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106599315
N-cyclopropyl-2-hydroxy-4-methyl-N-(piperidin-2-ylmethyl)benzamide
CID 106627042
5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyridine-2-carboxamide
CID 106626904
2-(2-chloro-6-fluorophenyl)-N-cyclopropyl-N-(pyrrolidin-2-ylmethyl)acetamide
CID 104974055
2,4-difluoro-N-(piperidin-2-ylmethyl)-N-propylbenzamide
CID 106625849
4-chloro-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]benzamide
CID 106600096
4-chloro-N-ethyl-2-fluoro-N-pyrrolidin-3-ylbenzamide
CID 63299739
N-cyclopropyl-3-hydroxy-N-(piperidin-2-ylmethyl)pyridine-4-carboxamide
CID 106626974
N-cyclopropyl-2-(4-fluorophenyl)-N-(piperidin-2-ylmethyl)acetamide
CID 106626819
4-chloro-N-(cyclopropylmethyl)-2-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106608308
4-chloro-N-cycloheptyl-2-fluoro-N-methylbenzamide
CID 112805278

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide?
The IUPAC name of 4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide (CID 106626825) is 4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide.
What is the SMILES notation for 4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide?
The canonical SMILES for 4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide is O=C(c1ccc(Cl)cc1F)N(CC1CCCCN1)C1CC1.
What is the InChIKey of 4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide?
The InChIKey is MHUNFSLQZYALHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20ClFN2O/c17-11-4-7-14(15(18)9-11)16(21)20(13-5-6-13)10-12-3-1-2-8-19-12/h4,7,9,12-13,19H,1-3,5-6,8,10H2.
What are the key properties of 4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide?
4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide has a molecular weight of 310.80 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide is sourced from PubChem (CID 106626825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).