2-amino-N-(4-fluoro-3-methoxyphenyl)-2-methylpropanamide

C11H15FN2O2 — CID 114839711

IUPAC2-amino-N-(4-fluoro-3-methoxyphenyl)-2-methylpropanamide
SMILESCOc1cc(NC(=O)C(C)(C)N)ccc1F
InChIInChI=1S/C11H15FN2O2/c1-11(2,13)10(15)14-7-4-5-8(12)9(6-7)16-3/h4-6H,13H2,1-3H3,(H,14,15)
InChIKeyOVHPWNSGQGCNLZ-UHFFFAOYSA-N
MW226.25 g/mol
LogP1.51
Rot. Bonds3

About 2-amino-N-(4-fluoro-3-methoxyphenyl)-2-methylpropanamide

2-amino-N-(4-fluoro-3-methoxyphenyl)-2-methylpropanamide (PubChem CID 114839711) has the molecular formula C11H15FN2O2 and a molecular weight of 226.25 g/mol. Its IUPAC name is 2-amino-N-(4-fluoro-3-methoxyphenyl)-2-methylpropanamide.

Molecular Properties

Compound Name2-amino-N-(4-fluoro-3-methoxyphenyl)-2-methylpropanamide
PubChem CID114839711
Molecular FormulaC11H15FN2O2
Molecular Weight226.25 g/mol
Exact Mass226.11
IUPAC Name2-amino-N-(4-fluoro-3-methoxyphenyl)-2-methylpropanamide
SMILESCOc1cc(NC(=O)C(C)(C)N)ccc1F
InChIInChI=1S/C11H15FN2O2/c1-11(2,13)10(15)14-7-4-5-8(12)9(6-7)16-3/h4-6H,13H2,1-3H3,(H,14,15)
InChIKeyOVHPWNSGQGCNLZ-UHFFFAOYSA-N
XLogP1.51
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.25
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[4-(carbamoylamino)-3-methoxyphenyl]-2-methylpropanamide
CID 119321312
2-amino-N-[4-methoxy-3-(2,2,2-trifluoroethoxy)phenyl]-2-methylpropanamide
CID 119286134
2-amino-N-[4-(methanesulfonamido)-3-methoxyphenyl]-2-methylpropanamide;hydrochloride
CID 119282644
ethyl N-(4-fluoro-3-methoxyphenyl)carbamate
CID 114840894
2-amino-N-(3-cyano-4-fluorophenyl)-2-methylpropanamide
CID 62315656
3-amino-N-(4-fluoro-3-methoxyphenyl)-3-sulfanylidenepropanamide
CID 114839886
2-bromo-N-(3-fluoro-4-methoxyphenyl)-2-methylpropanamide
CID 114327553
(3Z)-3-amino-N-(4-fluoro-3-methoxyphenyl)-3-hydroxyiminopropanamide
CID 114840498
2-amino-N-(4-methoxyphenyl)-2-methylpropanamide;hydrochloride
CID 56832266
N-(4-fluoro-3-methoxyphenyl)-4-hydroxybenzamide
CID 114840048
3-(4-fluoro-3-methoxyanilino)-2-methyl-3-oxopropanoic acid
CID 114899105
4-amino-N-(4-fluoro-3-methoxyphenyl)-2-(methylamino)-1,3-thiazole-5-carboxamide
CID 114841246

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-fluoro-3-methoxyphenyl)-2-methylpropanamide?
The IUPAC name of 2-amino-N-(4-fluoro-3-methoxyphenyl)-2-methylpropanamide (CID 114839711) is 2-amino-N-(4-fluoro-3-methoxyphenyl)-2-methylpropanamide.
What is the SMILES notation for 2-amino-N-(4-fluoro-3-methoxyphenyl)-2-methylpropanamide?
The canonical SMILES for 2-amino-N-(4-fluoro-3-methoxyphenyl)-2-methylpropanamide is COc1cc(NC(=O)C(C)(C)N)ccc1F.
What is the InChIKey of 2-amino-N-(4-fluoro-3-methoxyphenyl)-2-methylpropanamide?
The InChIKey is OVHPWNSGQGCNLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O2/c1-11(2,13)10(15)14-7-4-5-8(12)9(6-7)16-3/h4-6H,13H2,1-3H3,(H,14,15).
What are the key properties of 2-amino-N-(4-fluoro-3-methoxyphenyl)-2-methylpropanamide?
2-amino-N-(4-fluoro-3-methoxyphenyl)-2-methylpropanamide has a molecular weight of 226.25 g/mol, XLogP of 1.51, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-fluoro-3-methoxyphenyl)-2-methylpropanamide is sourced from PubChem (CID 114839711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).