N-(2-methylpiperidin-3-yl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide

C19H30N2O2 — CID 120574805

IUPACN-(2-methylpiperidin-3-yl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
SMILESCc1ccc(C(C)C)c(OC(C)C(=O)NC2CCCNC2C)c1
InChIInChI=1S/C19H30N2O2/c1-12(2)16-9-8-13(3)11-18(16)23-15(5)19(22)21-17-7-6-10-20-14(17)4/h8-9,11-12,14-15,17,20H,6-7,10H2,1-5H3,(H,21,22)
InChIKeyKEUVSXQSFFPJTN-UHFFFAOYSA-N
MW318.46 g/mol
LogP3.14
Rot. Bonds5

About N-(2-methylpiperidin-3-yl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide

N-(2-methylpiperidin-3-yl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide (PubChem CID 120574805) has the molecular formula C19H30N2O2 and a molecular weight of 318.46 g/mol. Its IUPAC name is N-(2-methylpiperidin-3-yl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide.

Molecular Properties

Compound NameN-(2-methylpiperidin-3-yl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
PubChem CID120574805
Molecular FormulaC19H30N2O2
Molecular Weight318.46 g/mol
Exact Mass318.23
IUPAC NameN-(2-methylpiperidin-3-yl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
SMILESCc1ccc(C(C)C)c(OC(C)C(=O)NC2CCCNC2C)c1
InChIInChI=1S/C19H30N2O2/c1-12(2)16-9-8-13(3)11-18(16)23-15(5)19(22)21-17-7-6-10-20-14(17)4/h8-9,11-12,14-15,17,20H,6-7,10H2,1-5H3,(H,21,22)
InChIKeyKEUVSXQSFFPJTN-UHFFFAOYSA-N
XLogP3.14
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-bromo-4-methylphenoxy)-N-(2-methylpiperidin-3-yl)propanamide
CID 120577698
2-(5-methyl-2-propan-2-ylphenoxy)-N-(pyrrolidin-2-ylmethyl)propanamide;hydrochloride
CID 119513815
2-(3-fluorophenoxy)-N-(2-methylpiperidin-3-yl)propanamide
CID 120576605
2-(3-bromophenoxy)-N-(2-methylpiperidin-3-yl)propanamide
CID 120577629
N-cyclopentyl-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide
CID 63650924
2-(5-methyl-2-propan-2-ylphenoxy)-N-(piperidin-3-ylmethyl)propanamide;hydrochloride
CID 119463702
(2R)-N-[(2R)-3-methylbutan-2-yl]-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 100572381
2-cycloheptyloxy-N-(2-methylpiperidin-3-yl)propanamide
CID 120576393
(2R)-N-(3-cyclopentyloxypropyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 100667207
N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 133160192
2-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxy-4-methylbenzoic acid
CID 60651700
2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 47095241

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpiperidin-3-yl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide?
The IUPAC name of N-(2-methylpiperidin-3-yl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide (CID 120574805) is N-(2-methylpiperidin-3-yl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide.
What is the SMILES notation for N-(2-methylpiperidin-3-yl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide?
The canonical SMILES for N-(2-methylpiperidin-3-yl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide is Cc1ccc(C(C)C)c(OC(C)C(=O)NC2CCCNC2C)c1.
What is the InChIKey of N-(2-methylpiperidin-3-yl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide?
The InChIKey is KEUVSXQSFFPJTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O2/c1-12(2)16-9-8-13(3)11-18(16)23-15(5)19(22)21-17-7-6-10-20-14(17)4/h8-9,11-12,14-15,17,20H,6-7,10H2,1-5H3,(H,21,22).
What are the key properties of N-(2-methylpiperidin-3-yl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide?
N-(2-methylpiperidin-3-yl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide has a molecular weight of 318.46 g/mol, XLogP of 3.14, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpiperidin-3-yl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide is sourced from PubChem (CID 120574805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).