2-amino-N-[[4-(2-methoxyphenoxy)phenyl]methyl]pentanamide

C19H24N2O3 — CID 119322060

IUPAC2-amino-N-[[4-(2-methoxyphenoxy)phenyl]methyl]pentanamide
SMILESCCCC(N)C(=O)NCc1ccc(Oc2ccccc2OC)cc1
InChIInChI=1S/C19H24N2O3/c1-3-6-16(20)19(22)21-13-14-9-11-15(12-10-14)24-18-8-5-4-7-17(18)23-2/h4-5,7-12,16H,3,6,13,20H2,1-2H3,(H,21,22)
InChIKeyRGEJZTVNFVZHJM-UHFFFAOYSA-N
MW328.41 g/mol
LogP3.23
Rot. Bonds8

About 2-amino-N-[[4-(2-methoxyphenoxy)phenyl]methyl]pentanamide

2-amino-N-[[4-(2-methoxyphenoxy)phenyl]methyl]pentanamide (PubChem CID 119322060) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 2-amino-N-[[4-(2-methoxyphenoxy)phenyl]methyl]pentanamide.

Molecular Properties

Compound Name2-amino-N-[[4-(2-methoxyphenoxy)phenyl]methyl]pentanamide
PubChem CID119322060
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name2-amino-N-[[4-(2-methoxyphenoxy)phenyl]methyl]pentanamide
SMILESCCCC(N)C(=O)NCc1ccc(Oc2ccccc2OC)cc1
InChIInChI=1S/C19H24N2O3/c1-3-6-16(20)19(22)21-13-14-9-11-15(12-10-14)24-18-8-5-4-7-17(18)23-2/h4-5,7-12,16H,3,6,13,20H2,1-2H3,(H,21,22)
InChIKeyRGEJZTVNFVZHJM-UHFFFAOYSA-N
XLogP3.23
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[[4-(2-methoxyphenoxy)phenyl]methyl]pentanamide?
The IUPAC name of 2-amino-N-[[4-(2-methoxyphenoxy)phenyl]methyl]pentanamide (CID 119322060) is 2-amino-N-[[4-(2-methoxyphenoxy)phenyl]methyl]pentanamide.
What is the SMILES notation for 2-amino-N-[[4-(2-methoxyphenoxy)phenyl]methyl]pentanamide?
The canonical SMILES for 2-amino-N-[[4-(2-methoxyphenoxy)phenyl]methyl]pentanamide is CCCC(N)C(=O)NCc1ccc(Oc2ccccc2OC)cc1.
What is the InChIKey of 2-amino-N-[[4-(2-methoxyphenoxy)phenyl]methyl]pentanamide?
The InChIKey is RGEJZTVNFVZHJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-3-6-16(20)19(22)21-13-14-9-11-15(12-10-14)24-18-8-5-4-7-17(18)23-2/h4-5,7-12,16H,3,6,13,20H2,1-2H3,(H,21,22).
What are the key properties of 2-amino-N-[[4-(2-methoxyphenoxy)phenyl]methyl]pentanamide?
2-amino-N-[[4-(2-methoxyphenoxy)phenyl]methyl]pentanamide has a molecular weight of 328.41 g/mol, XLogP of 3.23, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[[4-(2-methoxyphenoxy)phenyl]methyl]pentanamide is sourced from PubChem (CID 119322060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).