cyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone

C16H20Cl2N2O — CID 60789546

IUPACcyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone
SMILESO=C(C1CC1)N1CCC(NCc2cc(Cl)cc(Cl)c2)CC1
InChIInChI=1S/C16H20Cl2N2O/c17-13-7-11(8-14(18)9-13)10-19-15-3-5-20(6-4-15)16(21)12-1-2-12/h7-9,12,15,19H,1-6,10H2
InChIKeyZNVJCPNHOVPAHE-UHFFFAOYSA-N
MW327.25 g/mol
LogP3.48
Rot. Bonds4

About cyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone

cyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone (PubChem CID 60789546) has the molecular formula C16H20Cl2N2O and a molecular weight of 327.25 g/mol. Its IUPAC name is cyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone
PubChem CID60789546
Molecular FormulaC16H20Cl2N2O
Molecular Weight327.25 g/mol
Exact Mass326.10
IUPAC Namecyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone
SMILESO=C(C1CC1)N1CCC(NCc2cc(Cl)cc(Cl)c2)CC1
InChIInChI=1S/C16H20Cl2N2O/c17-13-7-11(8-14(18)9-13)10-19-15-3-5-20(6-4-15)16(21)12-1-2-12/h7-9,12,15,19H,1-6,10H2
InChIKeyZNVJCPNHOVPAHE-UHFFFAOYSA-N
XLogP3.48
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.25
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze cyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone 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

[4-[(3-chloro-4-methylphenyl)methylamino]piperidin-1-yl]-cyclopropylmethanone
CID 106816549
cyclopropyl-[4-[(3,4-difluorophenyl)methylamino]piperidin-1-yl]methanone
CID 43434746
cyclopropyl-[4-[(2,6-dichlorophenyl)methylamino]piperidin-1-yl]methanone
CID 43434750
[4-[(3-bromo-4-chlorophenyl)methylamino]piperidin-1-yl]-cyclopropylmethanone
CID 83232075
cyclopropyl-[4-[(3,4-dimethylphenyl)methylamino]piperidin-1-yl]methanone
CID 43434758
cyclopropyl-[4-[(2-hydroxyphenyl)methylamino]piperidin-1-yl]methanone
CID 43747864
cyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride
CID 56808716
1-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-(3,5-dichloroanilino)ethanone
CID 55900630
[4-[(4-bromothiophen-2-yl)methylamino]piperidin-1-yl]-cyclopropylmethanone
CID 43434784
1-[4-[(3-chloro-5-fluorophenyl)methylamino]piperidin-1-yl]-2-methoxyethanone
CID 114452598
cyclopropyl-[4-[(7-methoxy-1,3-benzodioxol-5-yl)methylamino]piperidin-1-yl]methanone
CID 56808723
cyclopropyl-[4-[[3-(2-methylphenyl)phenyl]methylamino]piperidin-1-yl]methanone
CID 56827303

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone?
The IUPAC name of cyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone (CID 60789546) is cyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone.
What is the SMILES notation for cyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone?
The canonical SMILES for cyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone is O=C(C1CC1)N1CCC(NCc2cc(Cl)cc(Cl)c2)CC1.
What is the InChIKey of cyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone?
The InChIKey is ZNVJCPNHOVPAHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20Cl2N2O/c17-13-7-11(8-14(18)9-13)10-19-15-3-5-20(6-4-15)16(21)12-1-2-12/h7-9,12,15,19H,1-6,10H2.
What are the key properties of cyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone?
cyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone has a molecular weight of 327.25 g/mol, XLogP of 3.48, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone is sourced from PubChem (CID 60789546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).