N-[3-[[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]phenyl]acetamide

C16H24N4O2 — CID 108884073

IUPACN-[3-[[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]phenyl]acetamide
SMILESCC(=O)Nc1cccc(NC(=O)N(C)C2CCN(C)CC2)c1
InChIInChI=1S/C16H24N4O2/c1-12(21)17-13-5-4-6-14(11-13)18-16(22)20(3)15-7-9-19(2)10-8-15/h4-6,11,15H,7-10H2,1-3H3,(H,17,21)(H,18,22)
InChIKeyOZVXTHAYAHDLAC-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.20
Rot. Bonds3

About N-[3-[[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]phenyl]acetamide

N-[3-[[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]phenyl]acetamide (PubChem CID 108884073) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-[3-[[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]phenyl]acetamide
PubChem CID108884073
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC NameN-[3-[[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]phenyl]acetamide
SMILESCC(=O)Nc1cccc(NC(=O)N(C)C2CCN(C)CC2)c1
InChIInChI=1S/C16H24N4O2/c1-12(21)17-13-5-4-6-14(11-13)18-16(22)20(3)15-7-9-19(2)10-8-15/h4-6,11,15H,7-10H2,1-3H3,(H,17,21)(H,18,22)
InChIKeyOZVXTHAYAHDLAC-UHFFFAOYSA-N
XLogP2.20
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 108895704
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CID 108894718
3-(2,6-dimethoxyphenyl)-1-methyl-1-(1-methylpiperidin-4-yl)urea
CID 108867823
3-[3-(3-methoxyphenyl)phenyl]-1-methyl-1-[(3R)-1-methylpyrrolidin-3-yl]urea
CID 97277934
3-(3-chlorophenyl)-1-cyclopropyl-1-(1-methylpiperidin-4-yl)urea
CID 110874785
3-(2-tert-butyl-1,3-dioxoisoindol-5-yl)-1-methyl-1-(1-methylpiperidin-4-yl)urea
CID 108873206
N'-(3-acetamidophenyl)-N-[(1-methylpiperidin-4-yl)methyl]oxamide
CID 16886569
1-methyl-1-(1-methylpiperidin-4-yl)-3-(2-phenoxypyrimidin-5-yl)urea
CID 166280765
1-methyl-1-[(3R)-1-methylpyrrolidin-3-yl]-3-[3-(1,3-thiazol-4-yl)phenyl]urea
CID 125174576
3-[(3-bromobenzoyl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 112834244
deuterium monohydride;1-methyl-1-(1-methylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)urea
CID 161217615
N-[3-[1-[(1-methylpiperidin-4-yl)amino]ethyl]phenyl]acetamide
CID 43206478

Frequently Asked Questions

What is the IUPAC name of N-[3-[[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]phenyl]acetamide?
The IUPAC name of N-[3-[[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]phenyl]acetamide (CID 108884073) is N-[3-[[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]phenyl]acetamide.
What is the SMILES notation for N-[3-[[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]phenyl]acetamide?
The canonical SMILES for N-[3-[[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]phenyl]acetamide is CC(=O)Nc1cccc(NC(=O)N(C)C2CCN(C)CC2)c1.
What is the InChIKey of N-[3-[[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]phenyl]acetamide?
The InChIKey is OZVXTHAYAHDLAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c1-12(21)17-13-5-4-6-14(11-13)18-16(22)20(3)15-7-9-19(2)10-8-15/h4-6,11,15H,7-10H2,1-3H3,(H,17,21)(H,18,22).
What are the key properties of N-[3-[[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]phenyl]acetamide?
N-[3-[[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]phenyl]acetamide has a molecular weight of 304.39 g/mol, XLogP of 2.20, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]phenyl]acetamide is sourced from PubChem (CID 108884073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).