ethane;N-(1-methylpiperidin-4-yl)benzamide

C15H24N2O — CID 142009687

IUPACethane;N-(1-methylpiperidin-4-yl)benzamide
SMILESCC.CN1CCC(NC(=O)c2ccccc2)CC1
InChIInChI=1S/C13H18N2O.C2H6/c1-15-9-7-12(8-10-15)14-13(16)11-5-3-2-4-6-11;1-2/h2-6,12H,7-10H2,1H3,(H,14,16);1-2H3
InChIKeyZLTOOBCPNGQKMH-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.54
Rot. Bonds2

About ethane;N-(1-methylpiperidin-4-yl)benzamide

ethane;N-(1-methylpiperidin-4-yl)benzamide (PubChem CID 142009687) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is ethane;N-(1-methylpiperidin-4-yl)benzamide.

Molecular Properties

Compound Nameethane;N-(1-methylpiperidin-4-yl)benzamide
PubChem CID142009687
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Nameethane;N-(1-methylpiperidin-4-yl)benzamide
SMILESCC.CN1CCC(NC(=O)c2ccccc2)CC1
InChIInChI=1S/C13H18N2O.C2H6/c1-15-9-7-12(8-10-15)14-13(16)11-5-3-2-4-6-11;1-2/h2-6,12H,7-10H2,1H3,(H,14,16);1-2H3
InChIKeyZLTOOBCPNGQKMH-UHFFFAOYSA-N
XLogP2.54
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(4-methylpiperazine-1-carbonyl)piperidin-4-yl]benzamide
CID 11674340
N-(1-methylpiperidin-4-yl)-3-oxo-3-phenylpropanamide
CID 110463372
N-(1-tert-butylpiperidin-4-yl)benzamide
CID 61036493
4-carbamothioyl-N-(1-methylpiperidin-4-yl)benzamide
CID 43373646
[4-[(1-methylpiperidin-4-yl)carbamoyl]phenyl]boronic acid
CID 140843225
4-acetamido-N-(1-methylpiperidin-4-yl)benzamide
CID 47114509
3-formyl-N-(1-methylpiperidin-4-yl)benzamide
CID 90104631
ethane;5-methyl-N-(1-methylpiperidin-4-yl)thiophene-3-carboxamide
CID 145257142
N-[1-[(1-methylpiperidin-4-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide
CID 71902056
N-[(3R)-1-tert-butylpyrrolidin-3-yl]benzamide
CID 155637447
N-[1-[2-(methylamino)acetyl]piperidin-4-yl]benzamide
CID 119698218
ethyl 4-benzamidopiperidine-1-carboxylate
CID 18120666

Frequently Asked Questions

What is the IUPAC name of ethane;N-(1-methylpiperidin-4-yl)benzamide?
The IUPAC name of ethane;N-(1-methylpiperidin-4-yl)benzamide (CID 142009687) is ethane;N-(1-methylpiperidin-4-yl)benzamide.
What is the SMILES notation for ethane;N-(1-methylpiperidin-4-yl)benzamide?
The canonical SMILES for ethane;N-(1-methylpiperidin-4-yl)benzamide is CC.CN1CCC(NC(=O)c2ccccc2)CC1.
What is the InChIKey of ethane;N-(1-methylpiperidin-4-yl)benzamide?
The InChIKey is ZLTOOBCPNGQKMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O.C2H6/c1-15-9-7-12(8-10-15)14-13(16)11-5-3-2-4-6-11;1-2/h2-6,12H,7-10H2,1H3,(H,14,16);1-2H3.
What are the key properties of ethane;N-(1-methylpiperidin-4-yl)benzamide?
ethane;N-(1-methylpiperidin-4-yl)benzamide has a molecular weight of 248.37 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(1-methylpiperidin-4-yl)benzamide is sourced from PubChem (CID 142009687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).