N-methyl-N-(1-methylpiperidin-4-yl)-3-propan-2-yloxybenzamide

C17H26N2O2 — CID 170788099

IUPACN-methyl-N-(1-methylpiperidin-4-yl)-3-propan-2-yloxybenzamide
SMILESCC(C)Oc1cccc(C(=O)N(C)C2CCN(C)CC2)c1
InChIInChI=1S/C17H26N2O2/c1-13(2)21-16-7-5-6-14(12-16)17(20)19(4)15-8-10-18(3)11-9-15/h5-7,12-13,15H,8-11H2,1-4H3
InChIKeyNKKOWTUFIVUAEJ-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.64
Rot. Bonds4

About N-methyl-N-(1-methylpiperidin-4-yl)-3-propan-2-yloxybenzamide

N-methyl-N-(1-methylpiperidin-4-yl)-3-propan-2-yloxybenzamide (PubChem CID 170788099) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-methyl-N-(1-methylpiperidin-4-yl)-3-propan-2-yloxybenzamide.

Molecular Properties

Compound NameN-methyl-N-(1-methylpiperidin-4-yl)-3-propan-2-yloxybenzamide
PubChem CID170788099
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-methyl-N-(1-methylpiperidin-4-yl)-3-propan-2-yloxybenzamide
SMILESCC(C)Oc1cccc(C(=O)N(C)C2CCN(C)CC2)c1
InChIInChI=1S/C17H26N2O2/c1-13(2)21-16-7-5-6-14(12-16)17(20)19(4)15-8-10-18(3)11-9-15/h5-7,12-13,15H,8-11H2,1-4H3
InChIKeyNKKOWTUFIVUAEJ-UHFFFAOYSA-N
XLogP2.64
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-piperidin-3-yl-3-propan-2-yloxybenzamide
CID 62920144
3-cyano-N-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 24706025
N-methyl-N-(1-methylpiperidin-4-yl)-3-pyridin-2-yloxybenzamide
CID 90596724
N-[(4aR,6R,7aR)-2-methyl-3-oxo-4,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyridin-6-yl]-N-methyl-3-propan-2-yloxybenzamide
CID 134703177
N-methyl-3-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]oxy-N-(oxan-4-yl)benzamide
CID 25280901
3-(difluoromethoxy)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)benzamide
CID 7428120
3,4-dihydroxy-N-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 103955316
3-[(3-bromobenzoyl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 112834244
(4-methylpiperidin-1-yl)-(3-propan-2-yloxyphenyl)methanone
CID 8779088
(1-methylpiperidin-3-yl)-(3-propan-2-yloxyphenyl)methanone
CID 45245966
[(3aS,6aS)-5-methyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-yl]-(3-propan-2-yloxyphenyl)methanone
CID 155873390
N-methyl-N-(1-methylpiperidin-4-yl)-2,3-dihydro-1H-indene-5-carboxamide
CID 39902838

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-methylpiperidin-4-yl)-3-propan-2-yloxybenzamide?
The IUPAC name of N-methyl-N-(1-methylpiperidin-4-yl)-3-propan-2-yloxybenzamide (CID 170788099) is N-methyl-N-(1-methylpiperidin-4-yl)-3-propan-2-yloxybenzamide.
What is the SMILES notation for N-methyl-N-(1-methylpiperidin-4-yl)-3-propan-2-yloxybenzamide?
The canonical SMILES for N-methyl-N-(1-methylpiperidin-4-yl)-3-propan-2-yloxybenzamide is CC(C)Oc1cccc(C(=O)N(C)C2CCN(C)CC2)c1.
What is the InChIKey of N-methyl-N-(1-methylpiperidin-4-yl)-3-propan-2-yloxybenzamide?
The InChIKey is NKKOWTUFIVUAEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13(2)21-16-7-5-6-14(12-16)17(20)19(4)15-8-10-18(3)11-9-15/h5-7,12-13,15H,8-11H2,1-4H3.
What are the key properties of N-methyl-N-(1-methylpiperidin-4-yl)-3-propan-2-yloxybenzamide?
N-methyl-N-(1-methylpiperidin-4-yl)-3-propan-2-yloxybenzamide has a molecular weight of 290.41 g/mol, XLogP of 2.64, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methylpiperidin-4-yl)-3-propan-2-yloxybenzamide is sourced from PubChem (CID 170788099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).