(2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone

C14H18F2N2O — CID 54923672

IUPAC(2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone
SMILESCCNC1CCN(C(=O)c2c(F)cccc2F)CC1
InChIInChI=1S/C14H18F2N2O/c1-2-17-10-6-8-18(9-7-10)14(19)13-11(15)4-3-5-12(13)16/h3-5,10,17H,2,6-9H2,1H3
InChIKeyPCGAKCIQQNFLFW-UHFFFAOYSA-N
MW268.31 g/mol
LogP2.18
Rot. Bonds3

About (2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone

(2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone (PubChem CID 54923672) has the molecular formula C14H18F2N2O and a molecular weight of 268.31 g/mol. Its IUPAC name is (2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone
PubChem CID54923672
Molecular FormulaC14H18F2N2O
Molecular Weight268.31 g/mol
Exact Mass268.14
IUPAC Name(2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone
SMILESCCNC1CCN(C(=O)c2c(F)cccc2F)CC1
InChIInChI=1S/C14H18F2N2O/c1-2-17-10-6-8-18(9-7-10)14(19)13-11(15)4-3-5-12(13)16/h3-5,10,17H,2,6-9H2,1H3
InChIKeyPCGAKCIQQNFLFW-UHFFFAOYSA-N
XLogP2.18
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.31
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-(ethylamino)piperidin-1-yl]-(3-fluoro-4-pyridinyl)methanone
CID 64950641
N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide
CID 110821572
(2,6-difluorophenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone
CID 114506517
[4-(ethylamino)piperidin-1-yl]-(4-fluoro-3-methoxyphenyl)methanone
CID 81283284
(2,6-difluorophenyl)-(4-ethylpiperazin-4-ium-1-yl)methanone
CID 7285657
1-[4-(2,6-difluorobenzoyl)piperazin-1-yl]-2-(methylamino)ethanone
CID 119756685
[4-(ethylamino)piperidin-1-yl]-(3-methylsulfonylphenyl)methanone
CID 60819092
(2,6-difluorophenyl)-(4-hydroxy-4-methylpiperidin-1-yl)methanone
CID 80707647
N-[1-(2,6-difluorobenzoyl)piperidin-4-yl]-3-methyl-1,2-oxazole-5-carboxamide
CID 47089070
N-cyclohexyl-4-(2,6-difluorobenzoyl)piperazine-1-carboxamide
CID 47784765
[4-(ethylamino)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone
CID 62919962
[4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone
CID 62851096

Frequently Asked Questions

What is the IUPAC name of (2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone?
The IUPAC name of (2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone (CID 54923672) is (2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone.
What is the SMILES notation for (2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone?
The canonical SMILES for (2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone is CCNC1CCN(C(=O)c2c(F)cccc2F)CC1.
What is the InChIKey of (2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone?
The InChIKey is PCGAKCIQQNFLFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N2O/c1-2-17-10-6-8-18(9-7-10)14(19)13-11(15)4-3-5-12(13)16/h3-5,10,17H,2,6-9H2,1H3.
What are the key properties of (2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone?
(2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone has a molecular weight of 268.31 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone is sourced from PubChem (CID 54923672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).