2-[2-(2-aminopropyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide

C16H24N2O3 — CID 60907032

IUPAC2-[2-(2-aminopropyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide
SMILESCOc1cccc(CC(C)N)c1OCC(=O)NCC1CC1
InChIInChI=1S/C16H24N2O3/c1-11(17)8-13-4-3-5-14(20-2)16(13)21-10-15(19)18-9-12-6-7-12/h3-5,11-12H,6-10,17H2,1-2H3,(H,18,19)
InChIKeyVRZNAKGEJOBDAZ-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.49
Rot. Bonds8

About 2-[2-(2-aminopropyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide

2-[2-(2-aminopropyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide (PubChem CID 60907032) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-[2-(2-aminopropyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide.

Molecular Properties

Compound Name2-[2-(2-aminopropyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide
PubChem CID60907032
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-[2-(2-aminopropyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide
SMILESCOc1cccc(CC(C)N)c1OCC(=O)NCC1CC1
InChIInChI=1S/C16H24N2O3/c1-11(17)8-13-4-3-5-14(20-2)16(13)21-10-15(19)18-9-12-6-7-12/h3-5,11-12H,6-10,17H2,1-2H3,(H,18,19)
InChIKeyVRZNAKGEJOBDAZ-UHFFFAOYSA-N
XLogP1.49
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminopropyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide?
The IUPAC name of 2-[2-(2-aminopropyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide (CID 60907032) is 2-[2-(2-aminopropyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide.
What is the SMILES notation for 2-[2-(2-aminopropyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide?
The canonical SMILES for 2-[2-(2-aminopropyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide is COc1cccc(CC(C)N)c1OCC(=O)NCC1CC1.
What is the InChIKey of 2-[2-(2-aminopropyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide?
The InChIKey is VRZNAKGEJOBDAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-11(17)8-13-4-3-5-14(20-2)16(13)21-10-15(19)18-9-12-6-7-12/h3-5,11-12H,6-10,17H2,1-2H3,(H,18,19).
What are the key properties of 2-[2-(2-aminopropyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide?
2-[2-(2-aminopropyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide has a molecular weight of 292.38 g/mol, XLogP of 1.49, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminopropyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide is sourced from PubChem (CID 60907032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).