naphthalen-1-yl-(1-propan-2-ylpiperidin-4-yl)methanone

C19H23NO — CID 144874180

IUPACnaphthalen-1-yl-(1-propan-2-ylpiperidin-4-yl)methanone
SMILESCC(C)N1CCC(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C19H23NO/c1-14(2)20-12-10-16(11-13-20)19(21)18-9-5-7-15-6-3-4-8-17(15)18/h3-9,14,16H,10-13H2,1-2H3
InChIKeyKNFBXKYNXWMJMX-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.14
Rot. Bonds3

About naphthalen-1-yl-(1-propan-2-ylpiperidin-4-yl)methanone

naphthalen-1-yl-(1-propan-2-ylpiperidin-4-yl)methanone (PubChem CID 144874180) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is naphthalen-1-yl-(1-propan-2-ylpiperidin-4-yl)methanone.

Molecular Properties

Compound Namenaphthalen-1-yl-(1-propan-2-ylpiperidin-4-yl)methanone
PubChem CID144874180
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Namenaphthalen-1-yl-(1-propan-2-ylpiperidin-4-yl)methanone
SMILESCC(C)N1CCC(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C19H23NO/c1-14(2)20-12-10-16(11-13-20)19(21)18-9-5-7-15-6-3-4-8-17(15)18/h3-9,14,16H,10-13H2,1-2H3
InChIKeyKNFBXKYNXWMJMX-UHFFFAOYSA-N
XLogP4.14
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

naphthalen-1-yl-(4-propan-2-ylcyclohexyl)methanone
CID 65425044
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-naphthalen-1-ylmethanone
CID 115997804
1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide
CID 24542998
1-[(1R)-1-naphthalen-1-ylethyl]piperidine-4-carboxylic acid
CID 155289856
(3-ethylcyclopentyl)-naphthalen-1-ylmethanone
CID 65409486
[(3S)-1-cyclobutylpiperidin-3-yl]-naphthalen-1-ylmethanone
CID 42357685
1-(1-naphthalen-1-ylpropan-2-yl)piperidine-4-carboxylic acid
CID 84751503
2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide
CID 86955156
3-methyl-1-[(3R)-3-(naphthalene-1-carbonyl)piperidin-1-yl]but-2-en-1-one
CID 25372306
[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-naphthalen-1-ylmethanone
CID 95728859
[6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-1-yl]-pyrrolidin-1-ylmethanone
CID 44578678
1,4-diazabicyclo[2.2.2]octan-2-yl(naphthalen-1-yl)methanone
CID 79960184

Frequently Asked Questions

What is the IUPAC name of naphthalen-1-yl-(1-propan-2-ylpiperidin-4-yl)methanone?
The IUPAC name of naphthalen-1-yl-(1-propan-2-ylpiperidin-4-yl)methanone (CID 144874180) is naphthalen-1-yl-(1-propan-2-ylpiperidin-4-yl)methanone.
What is the SMILES notation for naphthalen-1-yl-(1-propan-2-ylpiperidin-4-yl)methanone?
The canonical SMILES for naphthalen-1-yl-(1-propan-2-ylpiperidin-4-yl)methanone is CC(C)N1CCC(C(=O)c2cccc3ccccc23)CC1.
What is the InChIKey of naphthalen-1-yl-(1-propan-2-ylpiperidin-4-yl)methanone?
The InChIKey is KNFBXKYNXWMJMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-14(2)20-12-10-16(11-13-20)19(21)18-9-5-7-15-6-3-4-8-17(15)18/h3-9,14,16H,10-13H2,1-2H3.
What are the key properties of naphthalen-1-yl-(1-propan-2-ylpiperidin-4-yl)methanone?
naphthalen-1-yl-(1-propan-2-ylpiperidin-4-yl)methanone has a molecular weight of 281.40 g/mol, XLogP of 4.14, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalen-1-yl-(1-propan-2-ylpiperidin-4-yl)methanone is sourced from PubChem (CID 144874180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).