2-methyl-2-[(4-propoxyphenyl)methylamino]propanamide

C14H22N2O2 — CID 61221118

IUPAC2-methyl-2-[(4-propoxyphenyl)methylamino]propanamide
SMILESCCCOc1ccc(CNC(C)(C)C(N)=O)cc1
InChIInChI=1S/C14H22N2O2/c1-4-9-18-12-7-5-11(6-8-12)10-16-14(2,3)13(15)17/h5-8,16H,4,9-10H2,1-3H3,(H2,15,17)
InChIKeyHBRXZVWLMCLRHT-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.83
Rot. Bonds7

About 2-methyl-2-[(4-propoxyphenyl)methylamino]propanamide

2-methyl-2-[(4-propoxyphenyl)methylamino]propanamide (PubChem CID 61221118) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-methyl-2-[(4-propoxyphenyl)methylamino]propanamide.

Molecular Properties

Compound Name2-methyl-2-[(4-propoxyphenyl)methylamino]propanamide
PubChem CID61221118
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-methyl-2-[(4-propoxyphenyl)methylamino]propanamide
SMILESCCCOc1ccc(CNC(C)(C)C(N)=O)cc1
InChIInChI=1S/C14H22N2O2/c1-4-9-18-12-7-5-11(6-8-12)10-16-14(2,3)13(15)17/h5-8,16H,4,9-10H2,1-3H3,(H2,15,17)
InChIKeyHBRXZVWLMCLRHT-UHFFFAOYSA-N
XLogP1.83
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-methoxyphenyl)methylamino]-2-methylpropanamide
CID 61212921
2-[(4-ethoxyphenyl)methylamino]-2-methylpropanoic acid
CID 65263874
(4-propoxyphenyl)methylhydrazine
CID 53401453
2-[(4-propoxyphenyl)methylcarbamoylamino]propanediamide
CID 56796089
N-tert-butyl-2-[(4-propoxyphenyl)methylamino]propanamide
CID 115588909
2-methyl-2-[(4-pentoxyphenyl)methylamino]propan-1-ol
CID 28725557
3-(ethylamino)-3-(4-propoxyphenyl)butanamide
CID 65234068
2-methyl-3-(methylamino)-N-[(4-propoxyphenyl)methyl]propanamide
CID 119714366
(4-propoxyphenyl)methyl acetate
CID 150263336
2,2-dimethyl-N-[(4-propoxyphenyl)methyl]butan-1-amine
CID 113242961
4-[(4-propoxyphenoxy)methyl]benzamide
CID 24605968
2-chloro-N-[(4-propoxyphenyl)methyl]propanamide
CID 82109238

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[(4-propoxyphenyl)methylamino]propanamide?
The IUPAC name of 2-methyl-2-[(4-propoxyphenyl)methylamino]propanamide (CID 61221118) is 2-methyl-2-[(4-propoxyphenyl)methylamino]propanamide.
What is the SMILES notation for 2-methyl-2-[(4-propoxyphenyl)methylamino]propanamide?
The canonical SMILES for 2-methyl-2-[(4-propoxyphenyl)methylamino]propanamide is CCCOc1ccc(CNC(C)(C)C(N)=O)cc1.
What is the InChIKey of 2-methyl-2-[(4-propoxyphenyl)methylamino]propanamide?
The InChIKey is HBRXZVWLMCLRHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-4-9-18-12-7-5-11(6-8-12)10-16-14(2,3)13(15)17/h5-8,16H,4,9-10H2,1-3H3,(H2,15,17).
What are the key properties of 2-methyl-2-[(4-propoxyphenyl)methylamino]propanamide?
2-methyl-2-[(4-propoxyphenyl)methylamino]propanamide has a molecular weight of 250.34 g/mol, XLogP of 1.83, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[(4-propoxyphenyl)methylamino]propanamide is sourced from PubChem (CID 61221118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).