2-(cyclopropylmethylamino)-2-(2,4,6-trimethoxyphenyl)acetamide

C15H22N2O4 — CID 60995248

IUPAC2-(cyclopropylmethylamino)-2-(2,4,6-trimethoxyphenyl)acetamide
SMILESCOc1cc(OC)c(C(NCC2CC2)C(N)=O)c(OC)c1
InChIInChI=1S/C15H22N2O4/c1-19-10-6-11(20-2)13(12(7-10)21-3)14(15(16)18)17-8-9-4-5-9/h6-7,9,14,17H,4-5,8H2,1-3H3,(H2,16,18)
InChIKeyYHHONTBTHIYTJK-UHFFFAOYSA-N
MW294.35 g/mol
LogP1.24
Rot. Bonds8

About 2-(cyclopropylmethylamino)-2-(2,4,6-trimethoxyphenyl)acetamide

2-(cyclopropylmethylamino)-2-(2,4,6-trimethoxyphenyl)acetamide (PubChem CID 60995248) has the molecular formula C15H22N2O4 and a molecular weight of 294.35 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-2-(2,4,6-trimethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-2-(2,4,6-trimethoxyphenyl)acetamide
PubChem CID60995248
Molecular FormulaC15H22N2O4
Molecular Weight294.35 g/mol
Exact Mass294.16
IUPAC Name2-(cyclopropylmethylamino)-2-(2,4,6-trimethoxyphenyl)acetamide
SMILESCOc1cc(OC)c(C(NCC2CC2)C(N)=O)c(OC)c1
InChIInChI=1S/C15H22N2O4/c1-19-10-6-11(20-2)13(12(7-10)21-3)14(15(16)18)17-8-9-4-5-9/h6-7,9,14,17H,4-5,8H2,1-3H3,(H2,16,18)
InChIKeyYHHONTBTHIYTJK-UHFFFAOYSA-N
XLogP1.24
TPSA82.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-bromo-4-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide
CID 54916019
2-hydroxy-2-(2,4,6-trimethoxyphenyl)acetamide
CID 62225648
methyl 2-(propylamino)-2-(2,4,6-trimethoxyphenyl)acetate
CID 60796374
2-(cyclopropylmethylamino)-2-(2,4,5-trimethoxyphenyl)acetic acid
CID 61002329
ethyl 2-(methylamino)-2-(2,4,6-trimethoxyphenyl)acetate
CID 60787918
2-(2-methylpropylamino)-2-(2,4,6-trimethoxyphenyl)acetic acid
CID 61001191
methyl 2-amino-2-(2,4,6-trimethoxyphenyl)acetate
CID 14604184
2-(cyclopropylmethylamino)-2-(3-hydroxy-4-methoxyphenyl)acetic acid
CID 54894829
2-(5-chloro-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetic acid
CID 112515035
2-(cyclopropylmethylamino)-2-(4-fluoro-3-methylphenyl)acetamide
CID 62119932
2-(cyclopropylmethylamino)-2-(6-methoxynaphthalen-2-yl)acetic acid
CID 61001340
2-(cyclopropylmethylamino)-2-naphthalen-2-ylacetamide
CID 60995245

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-2-(2,4,6-trimethoxyphenyl)acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-2-(2,4,6-trimethoxyphenyl)acetamide (CID 60995248) is 2-(cyclopropylmethylamino)-2-(2,4,6-trimethoxyphenyl)acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-2-(2,4,6-trimethoxyphenyl)acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-2-(2,4,6-trimethoxyphenyl)acetamide is COc1cc(OC)c(C(NCC2CC2)C(N)=O)c(OC)c1.
What is the InChIKey of 2-(cyclopropylmethylamino)-2-(2,4,6-trimethoxyphenyl)acetamide?
The InChIKey is YHHONTBTHIYTJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4/c1-19-10-6-11(20-2)13(12(7-10)21-3)14(15(16)18)17-8-9-4-5-9/h6-7,9,14,17H,4-5,8H2,1-3H3,(H2,16,18).
What are the key properties of 2-(cyclopropylmethylamino)-2-(2,4,6-trimethoxyphenyl)acetamide?
2-(cyclopropylmethylamino)-2-(2,4,6-trimethoxyphenyl)acetamide has a molecular weight of 294.35 g/mol, XLogP of 1.24, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-2-(2,4,6-trimethoxyphenyl)acetamide is sourced from PubChem (CID 60995248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).