2-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-2-methylpentanamide

C19H23FN2O3 — CID 119751481

IUPAC2-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)Nc1ccc(Oc2ccccc2OC)c(F)c1
InChIInChI=1S/C19H23FN2O3/c1-4-11-19(2,21)18(23)22-13-9-10-15(14(20)12-13)25-17-8-6-5-7-16(17)24-3/h5-10,12H,4,11,21H2,1-3H3,(H,22,23)
InChIKeyVXAOBYJCAOIHRB-UHFFFAOYSA-N
MW346.40 g/mol
LogP4.08
Rot. Bonds7

About 2-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-2-methylpentanamide

2-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-2-methylpentanamide (PubChem CID 119751481) has the molecular formula C19H23FN2O3 and a molecular weight of 346.40 g/mol. Its IUPAC name is 2-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-2-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-2-methylpentanamide
PubChem CID119751481
Molecular FormulaC19H23FN2O3
Molecular Weight346.40 g/mol
Exact Mass346.17
IUPAC Name2-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)Nc1ccc(Oc2ccccc2OC)c(F)c1
InChIInChI=1S/C19H23FN2O3/c1-4-11-19(2,21)18(23)22-13-9-10-15(14(20)12-13)25-17-8-6-5-7-16(17)24-3/h5-10,12H,4,11,21H2,1-3H3,(H,22,23)
InChIKeyVXAOBYJCAOIHRB-UHFFFAOYSA-N
XLogP4.08
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.40
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(4-cyclobutyloxy-3-fluorophenyl)-2-methylpentanamide
CID 119811156
2-amino-N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-2-methylpentanamide;hydrochloride
CID 119739656
2-amino-N-(2-fluoro-4,5-dimethoxyphenyl)-2-methylpentanamide
CID 119778135
4-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-3-methoxybutanamide
CID 120590352
2-amino-1-(3-fluoro-4-methoxyphenyl)-2-methylpentan-1-one
CID 116557002
methyl N-[4-[(2-amino-2-methylpentanoyl)amino]phenyl]carbamate
CID 60848240
2-bromo-N-(3-fluoro-4-methoxyphenyl)-2-methylpropanamide
CID 114327553
2-amino-N-(3,5-difluoro-4-iodophenyl)-2-methylpentanamide;hydrochloride
CID 119764617
2-amino-N-[2-(3-fluoro-4-methoxyphenyl)ethyl]-2-methylpentanamide
CID 119774865
2-amino-N-(3-fluoro-4-pyrrolidin-1-ylphenyl)-2-methylpentanamide
CID 60928269
2-amino-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-methylpentanamide
CID 119677476
N-(3,4-difluorophenyl)-2-(2-methoxyphenyl)-2-methylpropanamide
CID 110438888

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-2-methylpentanamide?
The IUPAC name of 2-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-2-methylpentanamide (CID 119751481) is 2-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-2-methylpentanamide.
What is the SMILES notation for 2-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-2-methylpentanamide?
The canonical SMILES for 2-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-2-methylpentanamide is CCCC(C)(N)C(=O)Nc1ccc(Oc2ccccc2OC)c(F)c1.
What is the InChIKey of 2-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-2-methylpentanamide?
The InChIKey is VXAOBYJCAOIHRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O3/c1-4-11-19(2,21)18(23)22-13-9-10-15(14(20)12-13)25-17-8-6-5-7-16(17)24-3/h5-10,12H,4,11,21H2,1-3H3,(H,22,23).
What are the key properties of 2-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-2-methylpentanamide?
2-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-2-methylpentanamide has a molecular weight of 346.40 g/mol, XLogP of 4.08, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-fluoro-4-(2-methoxyphenoxy)phenyl]-2-methylpentanamide is sourced from PubChem (CID 119751481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).