(4-aminopiperidin-1-yl)-(2-phenoxyphenyl)methanone

C18H20N2O2 — CID 119373846

IUPAC(4-aminopiperidin-1-yl)-(2-phenoxyphenyl)methanone
SMILESNC1CCN(C(=O)c2ccccc2Oc2ccccc2)CC1
InChIInChI=1S/C18H20N2O2/c19-14-10-12-20(13-11-14)18(21)16-8-4-5-9-17(16)22-15-6-2-1-3-7-15/h1-9,14H,10-13,19H2
InChIKeyPGIUWONMXZLFCT-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.04
Rot. Bonds3

About (4-aminopiperidin-1-yl)-(2-phenoxyphenyl)methanone

(4-aminopiperidin-1-yl)-(2-phenoxyphenyl)methanone (PubChem CID 119373846) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is (4-aminopiperidin-1-yl)-(2-phenoxyphenyl)methanone.

Molecular Properties

Compound Name(4-aminopiperidin-1-yl)-(2-phenoxyphenyl)methanone
PubChem CID119373846
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name(4-aminopiperidin-1-yl)-(2-phenoxyphenyl)methanone
SMILESNC1CCN(C(=O)c2ccccc2Oc2ccccc2)CC1
InChIInChI=1S/C18H20N2O2/c19-14-10-12-20(13-11-14)18(21)16-8-4-5-9-17(16)22-15-6-2-1-3-7-15/h1-9,14H,10-13,19H2
InChIKeyPGIUWONMXZLFCT-UHFFFAOYSA-N
XLogP3.04
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopentyl-[4-(2-phenoxybenzoyl)piperazin-1-yl]methanone
CID 38390849
[4-(3-aminopropoxy)piperidin-1-yl]-(2-phenoxyphenyl)methanone;hydrochloride
CID 119662357
[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-(2-phenoxyphenyl)methanone
CID 133118283
[3-(hydroxymethyl)piperidin-1-yl]-(2-phenoxyphenyl)methanone
CID 110878410
(4-aminopiperidin-1-yl)-(2-methylphenyl)methanone;hydrochloride
CID 119372796
1-(2-phenoxybenzoyl)piperidine-3-carboxylic acid
CID 45429227
[3-(benzenesulfonyl)pyrrolidin-1-yl]-(2-phenoxyphenyl)methanone
CID 90584913
(4-methylsulfonylpiperazin-1-yl)-(2-phenoxyphenyl)methanone
CID 51252114
(2-phenoxyphenyl)-spiro[1,3-dihydroindene-2,4'-piperidine]-1'-ylmethanone
CID 175091556
[4-(6-methylpyridazin-3-yl)oxypiperidin-1-yl]-(2-phenoxyphenyl)methanone
CID 90559487
[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(2-phenoxyphenyl)methanone
CID 47061076
3-oxa-9-azaspiro[5.5]undecan-9-yl-(2-phenoxyphenyl)methanone
CID 91784088

Frequently Asked Questions

What is the IUPAC name of (4-aminopiperidin-1-yl)-(2-phenoxyphenyl)methanone?
The IUPAC name of (4-aminopiperidin-1-yl)-(2-phenoxyphenyl)methanone (CID 119373846) is (4-aminopiperidin-1-yl)-(2-phenoxyphenyl)methanone.
What is the SMILES notation for (4-aminopiperidin-1-yl)-(2-phenoxyphenyl)methanone?
The canonical SMILES for (4-aminopiperidin-1-yl)-(2-phenoxyphenyl)methanone is NC1CCN(C(=O)c2ccccc2Oc2ccccc2)CC1.
What is the InChIKey of (4-aminopiperidin-1-yl)-(2-phenoxyphenyl)methanone?
The InChIKey is PGIUWONMXZLFCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c19-14-10-12-20(13-11-14)18(21)16-8-4-5-9-17(16)22-15-6-2-1-3-7-15/h1-9,14H,10-13,19H2.
What are the key properties of (4-aminopiperidin-1-yl)-(2-phenoxyphenyl)methanone?
(4-aminopiperidin-1-yl)-(2-phenoxyphenyl)methanone has a molecular weight of 296.37 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminopiperidin-1-yl)-(2-phenoxyphenyl)methanone is sourced from PubChem (CID 119373846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).