N-cyclopropyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide

C14H19NO4 — CID 43416729

IUPACN-cyclopropyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide
SMILESCOc1cc(C(C)O)ccc1OCC(=O)NC1CC1
InChIInChI=1S/C14H19NO4/c1-9(16)10-3-6-12(13(7-10)18-2)19-8-14(17)15-11-4-5-11/h3,6-7,9,11,16H,4-5,8H2,1-2H3,(H,15,17)
InChIKeyGXDOLKGZAXWPJA-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.41
Rot. Bonds6

About N-cyclopropyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide

N-cyclopropyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide (PubChem CID 43416729) has the molecular formula C14H19NO4 and a molecular weight of 265.31 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide
PubChem CID43416729
Molecular FormulaC14H19NO4
Molecular Weight265.31 g/mol
Exact Mass265.13
IUPAC NameN-cyclopropyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide
SMILESCOc1cc(C(C)O)ccc1OCC(=O)NC1CC1
InChIInChI=1S/C14H19NO4/c1-9(16)10-3-6-12(13(7-10)18-2)19-8-14(17)15-11-4-5-11/h3,6-7,9,11,16H,4-5,8H2,1-2H3,(H,15,17)
InChIKeyGXDOLKGZAXWPJA-UHFFFAOYSA-N
XLogP1.41
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2-[4-[(1S)-1-hydroxyethyl]-2-methoxyphenoxy]acetamide
CID 78931618
N-cyclopentyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide
CID 43416744
N-cyclopropyl-2-(2-methoxy-4-propan-2-ylphenoxy)acetamide
CID 177158445
N-cyclopropyl-2-[2-methoxy-4-[1-(methylamino)ethyl]phenoxy]acetamide
CID 43279426
2-[4-[(1S)-1-hydroxyethyl]-2-methoxyphenoxy]-N-(3-methylbutan-2-yl)acetamide
CID 78933810
2-[4-[(1R)-1-hydroxyethyl]-2-methoxyphenoxy]-N-(3-methylbutan-2-yl)acetamide
CID 63364548
N-cyclopropyl-2-[2-[(1R)-1-hydroxyethyl]-5-methoxyphenoxy]acetamide
CID 82001807
2-[4-(2-aminobutyl)-2-methoxyphenoxy]-N-cyclopropylacetamide
CID 60908010
2-[4-[(1S)-1-hydroxyethyl]-2-methoxyphenoxy]-N-(2-methoxyethyl)acetamide
CID 78931398
2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]-N-(2-methoxyethyl)acetamide
CID 60728745
2-[4-[(1S)-1-hydroxyethyl]-2-methoxyphenoxy]-N-(2,2,2-trifluoroethyl)acetamide
CID 78933804
N-cyclopropyl-2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetamide
CID 7973430

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide?
The IUPAC name of N-cyclopropyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide (CID 43416729) is N-cyclopropyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide?
The canonical SMILES for N-cyclopropyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide is COc1cc(C(C)O)ccc1OCC(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide?
The InChIKey is GXDOLKGZAXWPJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO4/c1-9(16)10-3-6-12(13(7-10)18-2)19-8-14(17)15-11-4-5-11/h3,6-7,9,11,16H,4-5,8H2,1-2H3,(H,15,17).
What are the key properties of N-cyclopropyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide?
N-cyclopropyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide has a molecular weight of 265.31 g/mol, XLogP of 1.41, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide is sourced from PubChem (CID 43416729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).