(3R)-N-(3-chlorophenyl)-3-[(3-fluorophenyl)methoxy]piperidine-1-carboxamide

C19H20ClFN2O2 — CID 93224006

IUPAC(3R)-N-(3-chlorophenyl)-3-[(3-fluorophenyl)methoxy]piperidine-1-carboxamide
SMILESO=C(Nc1cccc(Cl)c1)N1CCC[C@@H](OCc2cccc(F)c2)C1
InChIInChI=1S/C19H20ClFN2O2/c20-15-5-2-7-17(11-15)22-19(24)23-9-3-8-18(12-23)25-13-14-4-1-6-16(21)10-14/h1-2,4-7,10-11,18H,3,8-9,12-13H2,(H,22,24)/t18-/m1/s1
InChIKeyIDJZMNQMNQIKSR-GOSISDBHSA-N
MW362.83 g/mol
LogP4.69
Rot. Bonds4

About (3R)-N-(3-chlorophenyl)-3-[(3-fluorophenyl)methoxy]piperidine-1-carboxamide

(3R)-N-(3-chlorophenyl)-3-[(3-fluorophenyl)methoxy]piperidine-1-carboxamide (PubChem CID 93224006) has the molecular formula C19H20ClFN2O2 and a molecular weight of 362.83 g/mol. Its IUPAC name is (3R)-N-(3-chlorophenyl)-3-[(3-fluorophenyl)methoxy]piperidine-1-carboxamide.

Molecular Properties

Compound Name(3R)-N-(3-chlorophenyl)-3-[(3-fluorophenyl)methoxy]piperidine-1-carboxamide
PubChem CID93224006
Molecular FormulaC19H20ClFN2O2
Molecular Weight362.83 g/mol
Exact Mass362.12
IUPAC Name(3R)-N-(3-chlorophenyl)-3-[(3-fluorophenyl)methoxy]piperidine-1-carboxamide
SMILESO=C(Nc1cccc(Cl)c1)N1CCC[C@@H](OCc2cccc(F)c2)C1
InChIInChI=1S/C19H20ClFN2O2/c20-15-5-2-7-17(11-15)22-19(24)23-9-3-8-18(12-23)25-13-14-4-1-6-16(21)10-14/h1-2,4-7,10-11,18H,3,8-9,12-13H2,(H,22,24)/t18-/m1/s1
InChIKeyIDJZMNQMNQIKSR-GOSISDBHSA-N
XLogP4.69
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.83
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-[(4-bromophenyl)methoxy]-N-(3-chlorophenyl)piperidine-1-carboxamide
CID 93224012
3-ethoxy-N-(3-fluorophenyl)piperidine-1-carboxamide
CID 47073858
2-(4-chlorophenoxy)-1-[3-[(3-fluorophenyl)methoxy]piperidin-1-yl]ethanone
CID 42844150
(3,4-dichlorophenyl)-[3-[(3-fluorophenyl)methoxy]piperidin-1-yl]methanone
CID 42844152
3-[(2,5-difluorophenyl)methoxy]-N-phenylpiperidine-1-carboxamide
CID 46029181
(3-chlorophenyl)-[3-[(3-chlorophenyl)methoxy]piperidin-1-yl]methanone
CID 46028796
1-[(3S)-3-[(3-chlorophenyl)methoxy]piperidin-1-yl]propan-1-one
CID 93223396
(2-chlorophenyl)-[(3R)-3-[(3-chlorophenyl)methoxy]piperidin-1-yl]methanone
CID 93223391
[3-[(3-fluorophenyl)methoxy]piperidin-1-yl]-(4-methylphenyl)methanone
CID 42844148
N-(3-chlorophenyl)-3-hydroxypiperidine-1-carboxamide
CID 17392993
methyl (3S)-1-[(3-chlorophenyl)carbamoyl]piperidine-3-carboxylate
CID 79039547
[3-[(3-fluorophenyl)methoxy]piperidin-1-yl]-(4-nitrophenyl)methanone
CID 42844155

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(3-chlorophenyl)-3-[(3-fluorophenyl)methoxy]piperidine-1-carboxamide?
The IUPAC name of (3R)-N-(3-chlorophenyl)-3-[(3-fluorophenyl)methoxy]piperidine-1-carboxamide (CID 93224006) is (3R)-N-(3-chlorophenyl)-3-[(3-fluorophenyl)methoxy]piperidine-1-carboxamide.
What is the SMILES notation for (3R)-N-(3-chlorophenyl)-3-[(3-fluorophenyl)methoxy]piperidine-1-carboxamide?
The canonical SMILES for (3R)-N-(3-chlorophenyl)-3-[(3-fluorophenyl)methoxy]piperidine-1-carboxamide is O=C(Nc1cccc(Cl)c1)N1CCC[C@@H](OCc2cccc(F)c2)C1.
What is the InChIKey of (3R)-N-(3-chlorophenyl)-3-[(3-fluorophenyl)methoxy]piperidine-1-carboxamide?
The InChIKey is IDJZMNQMNQIKSR-GOSISDBHSA-N. The full InChI is InChI=1S/C19H20ClFN2O2/c20-15-5-2-7-17(11-15)22-19(24)23-9-3-8-18(12-23)25-13-14-4-1-6-16(21)10-14/h1-2,4-7,10-11,18H,3,8-9,12-13H2,(H,22,24)/t18-/m1/s1.
What are the key properties of (3R)-N-(3-chlorophenyl)-3-[(3-fluorophenyl)methoxy]piperidine-1-carboxamide?
(3R)-N-(3-chlorophenyl)-3-[(3-fluorophenyl)methoxy]piperidine-1-carboxamide has a molecular weight of 362.83 g/mol, XLogP of 4.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(3-chlorophenyl)-3-[(3-fluorophenyl)methoxy]piperidine-1-carboxamide is sourced from PubChem (CID 93224006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).