2-[2-(cyclopropylmethoxy)-3,5-difluorophenyl]piperidine

C15H19F2NO — CID 117421632

IUPAC2-[2-(cyclopropylmethoxy)-3,5-difluorophenyl]piperidine
SMILESFc1cc(F)c(OCC2CC2)c(C2CCCCN2)c1
InChIInChI=1S/C15H19F2NO/c16-11-7-12(14-3-1-2-6-18-14)15(13(17)8-11)19-9-10-4-5-10/h7-8,10,14,18H,1-6,9H2
InChIKeySKKOWUCNRLYVLL-UHFFFAOYSA-N
MW267.32 g/mol
LogP3.57
Rot. Bonds4

About 2-[2-(cyclopropylmethoxy)-3,5-difluorophenyl]piperidine

2-[2-(cyclopropylmethoxy)-3,5-difluorophenyl]piperidine (PubChem CID 117421632) has the molecular formula C15H19F2NO and a molecular weight of 267.32 g/mol. Its IUPAC name is 2-[2-(cyclopropylmethoxy)-3,5-difluorophenyl]piperidine.

Molecular Properties

Compound Name2-[2-(cyclopropylmethoxy)-3,5-difluorophenyl]piperidine
PubChem CID117421632
Molecular FormulaC15H19F2NO
Molecular Weight267.32 g/mol
Exact Mass267.14
IUPAC Name2-[2-(cyclopropylmethoxy)-3,5-difluorophenyl]piperidine
SMILESFc1cc(F)c(OCC2CC2)c(C2CCCCN2)c1
InChIInChI=1S/C15H19F2NO/c16-11-7-12(14-3-1-2-6-18-14)15(13(17)8-11)19-9-10-4-5-10/h7-8,10,14,18H,1-6,9H2
InChIKeySKKOWUCNRLYVLL-UHFFFAOYSA-N
XLogP3.57
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-(cyclopropylmethoxy)-3,5-difluorophenyl]piperidine
CID 117421628
(2S)-2-(3,5-difluoro-2-methoxyphenyl)pyrrolidine
CID 66518820
2-[3-chloro-2-(cyclopropylmethoxy)-5-methylphenyl]piperidine
CID 117449166
2-[3-chloro-2-(cyclopropylmethoxy)phenyl]piperidine
CID 117418878
2-(2,3,5-trifluorophenyl)pyrrolidine
CID 77131470
(2S)-2-(2,3,5-trifluorophenyl)pyrrolidine;hydrochloride
CID 171196335
2-(cyclopropylmethoxy)-3,5-difluorobenzonitrile
CID 69036852
(2S)-2-(2,5-difluorophenyl)pyrrolidine
CID 7176288
2-(cyclopropylmethoxy)-1-(1,1-dideuterio-2,2-dimethylpropyl)-3,5-difluorobenzene
CID 155606915
2-(5-fluoro-2-methoxy-3-methylsulfanylphenyl)pyrrolidine
CID 117355654
3,5-difluoro-2-[(2R)-piperidin-2-yl]pyridine
CID 130748594
2-(3-fluoro-5-methylphenyl)piperidine
CID 55297533

Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclopropylmethoxy)-3,5-difluorophenyl]piperidine?
The IUPAC name of 2-[2-(cyclopropylmethoxy)-3,5-difluorophenyl]piperidine (CID 117421632) is 2-[2-(cyclopropylmethoxy)-3,5-difluorophenyl]piperidine.
What is the SMILES notation for 2-[2-(cyclopropylmethoxy)-3,5-difluorophenyl]piperidine?
The canonical SMILES for 2-[2-(cyclopropylmethoxy)-3,5-difluorophenyl]piperidine is Fc1cc(F)c(OCC2CC2)c(C2CCCCN2)c1.
What is the InChIKey of 2-[2-(cyclopropylmethoxy)-3,5-difluorophenyl]piperidine?
The InChIKey is SKKOWUCNRLYVLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F2NO/c16-11-7-12(14-3-1-2-6-18-14)15(13(17)8-11)19-9-10-4-5-10/h7-8,10,14,18H,1-6,9H2.
What are the key properties of 2-[2-(cyclopropylmethoxy)-3,5-difluorophenyl]piperidine?
2-[2-(cyclopropylmethoxy)-3,5-difluorophenyl]piperidine has a molecular weight of 267.32 g/mol, XLogP of 3.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclopropylmethoxy)-3,5-difluorophenyl]piperidine is sourced from PubChem (CID 117421632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).