2-(methylamino)-N-(4-propoxyphenyl)acetamide

C12H18N2O2 — CID 54820943

IUPAC2-(methylamino)-N-(4-propoxyphenyl)acetamide
SMILESCCCOc1ccc(NC(=O)CNC)cc1
InChIInChI=1S/C12H18N2O2/c1-3-8-16-11-6-4-10(5-7-11)14-12(15)9-13-2/h4-7,13H,3,8-9H2,1-2H3,(H,14,15)
InChIKeyNZORTTKZPICQSO-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.63
Rot. Bonds6

About 2-(methylamino)-N-(4-propoxyphenyl)acetamide

2-(methylamino)-N-(4-propoxyphenyl)acetamide (PubChem CID 54820943) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-(methylamino)-N-(4-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(methylamino)-N-(4-propoxyphenyl)acetamide
PubChem CID54820943
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name2-(methylamino)-N-(4-propoxyphenyl)acetamide
SMILESCCCOc1ccc(NC(=O)CNC)cc1
InChIInChI=1S/C12H18N2O2/c1-3-8-16-11-6-4-10(5-7-11)14-12(15)9-13-2/h4-7,13H,3,8-9H2,1-2H3,(H,14,15)
InChIKeyNZORTTKZPICQSO-UHFFFAOYSA-N
XLogP1.63
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-propoxyanilino)-N-(4-propoxyphenyl)acetamide
CID 54820383
N-[4-(2-methoxyethoxy)phenyl]-2-(methylamino)acetamide;hydrochloride
CID 119723419
2-(4-methylphenoxy)-N-(4-propoxyphenyl)acetamide
CID 4943007
2-(cyclopropylmethylamino)-N-(4-propoxyphenyl)acetamide
CID 55060300
2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide
CID 54811098
2-(hexadecylamino)-N-(4-propoxyphenyl)acetamide
CID 54808874
3-chloro-N-(4-propoxyphenyl)propanamide
CID 62329515
N-(4-butoxyphenyl)-2-(ethylamino)acetamide
CID 54821038
N-[4-(3-methylbutoxy)phenyl]-2-(4-propoxyanilino)acetamide
CID 54820417
N-(4-methoxyphenyl)-2-(4-propoxyphenoxy)acetamide
CID 4732668
propyl 4-[[2-(methylamino)acetyl]amino]benzoate
CID 54821114
N-[4-[[2-(4-butoxyanilino)-2-oxoethyl]amino]phenyl]propanamide
CID 54835555

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(4-propoxyphenyl)acetamide?
The IUPAC name of 2-(methylamino)-N-(4-propoxyphenyl)acetamide (CID 54820943) is 2-(methylamino)-N-(4-propoxyphenyl)acetamide.
What is the SMILES notation for 2-(methylamino)-N-(4-propoxyphenyl)acetamide?
The canonical SMILES for 2-(methylamino)-N-(4-propoxyphenyl)acetamide is CCCOc1ccc(NC(=O)CNC)cc1.
What is the InChIKey of 2-(methylamino)-N-(4-propoxyphenyl)acetamide?
The InChIKey is NZORTTKZPICQSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-3-8-16-11-6-4-10(5-7-11)14-12(15)9-13-2/h4-7,13H,3,8-9H2,1-2H3,(H,14,15).
What are the key properties of 2-(methylamino)-N-(4-propoxyphenyl)acetamide?
2-(methylamino)-N-(4-propoxyphenyl)acetamide has a molecular weight of 222.29 g/mol, XLogP of 1.63, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(4-propoxyphenyl)acetamide is sourced from PubChem (CID 54820943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).