CID 161147503

C16H28FNO — CID 161147503

IUPAC—
SMILESC.CC(C)c1ccc(OCCN2CCCC2)cc1.[3H]F
InChIInChI=1S/C15H23NO.CH4.FH/c1-13(2)14-5-7-15(8-6-14)17-12-11-16-9-3-4-10-16;;/h5-8,13H,3-4,9-12H2,1-2H3;1H4;1H/i/hT
InChIKeyUOGCMMDXPJQHCV-MNYXATJNSA-N
MW271.41 g/mol
LogP4.07
Rot. Bonds5

About CID 161147503

CID 161147503 (PubChem CID 161147503) has the molecular formula C16H28FNO and a molecular weight of 271.41 g/mol.

Molecular Properties

Compound NameCID 161147503
PubChem CID161147503
Molecular FormulaC16H28FNO
Molecular Weight271.41 g/mol
Exact Mass271.22
IUPAC Name—
SMILESC.CC(C)c1ccc(OCCN2CCCC2)cc1.[3H]F
InChIInChI=1S/C15H23NO.CH4.FH/c1-13(2)14-5-7-15(8-6-14)17-12-11-16-9-3-4-10-16;;/h5-8,13H,3-4,9-12H2,1-2H3;1H4;1H/i/hT
InChIKeyUOGCMMDXPJQHCV-MNYXATJNSA-N
XLogP4.07
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.41
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-[3,5-di(propan-2-yl)phenoxy]ethyl]piperidine
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(1S)-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]propan-1-ol
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1-[2-(3-propan-2-ylphenoxy)ethyl]pyrrolidine
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(1S)-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]propan-1-amine
CID 78937096
1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine
CID 803619
3,3-difluoro-1-[2-(4-propan-2-ylphenoxy)ethyl]azetidine
CID 59551775
(4-chlorophenyl)-[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol
CID 23553296
1-[2-(4-methoxyphenoxy)ethyl]azepane
CID 888209
1-[3-(4-butan-2-ylphenoxy)propyl]piperidine;methane
CID 161298234
(2S)-2-amino-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol
CID 66515465
1-[2-(4-propoxyphenoxy)ethyl]piperidine;hydrochloride
CID 3030633
1-[2-(4-butan-2-ylphenoxy)ethyl]piperidine;oxalic acid
CID 2923057

Frequently Asked Questions

What is the IUPAC name of CID 161147503?
The IUPAC name of CID 161147503 (CID 161147503) is not available.
What is the SMILES notation for CID 161147503?
The canonical SMILES for CID 161147503 is C.CC(C)c1ccc(OCCN2CCCC2)cc1.[3H]F.
What is the InChIKey of CID 161147503?
The InChIKey is UOGCMMDXPJQHCV-MNYXATJNSA-N. The full InChI is InChI=1S/C15H23NO.CH4.FH/c1-13(2)14-5-7-15(8-6-14)17-12-11-16-9-3-4-10-16;;/h5-8,13H,3-4,9-12H2,1-2H3;1H4;1H/i/hT.
What are the key properties of CID 161147503?
CID 161147503 has a molecular weight of 271.41 g/mol, XLogP of 4.07, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 161147503 is sourced from PubChem (CID 161147503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).