4-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide

C14H22N2O3 — CID 120560553

IUPAC4-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide
SMILESCOc1ccccc1C(O)CNC(=O)CCC(C)N
InChIInChI=1S/C14H22N2O3/c1-10(15)7-8-14(18)16-9-12(17)11-5-3-4-6-13(11)19-2/h3-6,10,12,17H,7-9,15H2,1-2H3,(H,16,18)
InChIKeyHGLAPDSFMGEHBX-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.97
Rot. Bonds7

About 4-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide

4-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide (PubChem CID 120560553) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is 4-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide.

Molecular Properties

Compound Name4-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide
PubChem CID120560553
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name4-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide
SMILESCOc1ccccc1C(O)CNC(=O)CCC(C)N
InChIInChI=1S/C14H22N2O3/c1-10(15)7-8-14(18)16-9-12(17)11-5-3-4-6-13(11)19-2/h3-6,10,12,17H,7-9,15H2,1-2H3,(H,16,18)
InChIKeyHGLAPDSFMGEHBX-UHFFFAOYSA-N
XLogP0.97
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide
CID 119293185
N-(3-aminobutyl)-3-(2-methoxyphenyl)butanamide;hydrochloride
CID 119495811
2-(cyclopropylmethylamino)-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]acetamide;hydrochloride
CID 119730492
N-[2-hydroxy-2-(2-methylphenyl)ethyl]-4-methylpentanamide
CID 111119754
1-(2-methoxyphenyl)-2-(methylamino)ethanol
CID 14888491
N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]-3-piperidin-4-ylbutanamide
CID 119730501
N-(2-aminopropyl)-2-(2-methoxyphenoxy)acetamide
CID 82354186
4-amino-N-[(2-methoxynaphthalen-1-yl)methyl]pentanamide;hydrochloride
CID 120559869
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]acetamide
CID 119730495
2-amino-N-[2-(2,6-dimethoxyphenyl)-2-hydroxyethyl]acetamide
CID 86092021
N-(3-aminobutyl)-2-(2-methoxyphenyl)acetamide;hydrochloride
CID 75369473
N-(3-aminobutyl)-2-(2-methoxyphenoxy)acetamide;hydrochloride
CID 119494768

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide?
The IUPAC name of 4-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide (CID 120560553) is 4-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide.
What is the SMILES notation for 4-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide?
The canonical SMILES for 4-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide is COc1ccccc1C(O)CNC(=O)CCC(C)N.
What is the InChIKey of 4-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide?
The InChIKey is HGLAPDSFMGEHBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-10(15)7-8-14(18)16-9-12(17)11-5-3-4-6-13(11)19-2/h3-6,10,12,17H,7-9,15H2,1-2H3,(H,16,18).
What are the key properties of 4-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide?
4-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide has a molecular weight of 266.34 g/mol, XLogP of 0.97, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide is sourced from PubChem (CID 120560553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).