2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide

C14H22N2O2 — CID 43705705

IUPAC2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide
SMILESCNCC(=O)NC(C)c1cccc(OC(C)C)c1
InChIInChI=1S/C14H22N2O2/c1-10(2)18-13-7-5-6-12(8-13)11(3)16-14(17)9-15-4/h5-8,10-11,15H,9H2,1-4H3,(H,16,17)
InChIKeyLOFSUWHDAJWTDT-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.87
Rot. Bonds6

About 2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide

2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide (PubChem CID 43705705) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide
PubChem CID43705705
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide
SMILESCNCC(=O)NC(C)c1cccc(OC(C)C)c1
InChIInChI=1S/C14H22N2O2/c1-10(2)18-13-7-5-6-12(8-13)11(3)16-14(17)9-15-4/h5-8,10-11,15H,9H2,1-4H3,(H,16,17)
InChIKeyLOFSUWHDAJWTDT-UHFFFAOYSA-N
XLogP1.87
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(propan-2-ylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]propanamide
CID 60852899
4-chloro-N-[1-(3-propan-2-yloxyphenyl)ethyl]butanamide
CID 63307817
(2R)-2-amino-N-[1-(3-propan-2-yloxyphenyl)ethyl]propanamide
CID 54995688
2,2,2-trifluoro-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide
CID 62729345
2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide
CID 94488168
1,2-dimethyl-3-[1-(3-propan-2-yloxyphenyl)ethyl]guanidine
CID 51131497
3-methyl-N-[1-(3-propan-2-yloxyphenyl)ethyl]but-2-enamide
CID 47210467
1,2-dimethyl-3-[(1R)-1-(3-propan-2-yloxyphenyl)ethyl]guanidine
CID 52516530
(2S,3S)-2-amino-3-methyl-N-[1-(3-propan-2-yloxyphenyl)ethyl]pentanamide
CID 61178738
2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide
CID 120622083
4-(5-methylthiophen-2-yl)-4-oxo-N-[1-(3-propan-2-yloxyphenyl)ethyl]butanamide
CID 55713603
2-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide
CID 55717688

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide?
The IUPAC name of 2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide (CID 43705705) is 2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide is CNCC(=O)NC(C)c1cccc(OC(C)C)c1.
What is the InChIKey of 2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide?
The InChIKey is LOFSUWHDAJWTDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-10(2)18-13-7-5-6-12(8-13)11(3)16-14(17)9-15-4/h5-8,10-11,15H,9H2,1-4H3,(H,16,17).
What are the key properties of 2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide?
2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide has a molecular weight of 250.34 g/mol, XLogP of 1.87, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide is sourced from PubChem (CID 43705705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).