2-[(4-propan-2-yloxyphenyl)methylamino]acetamide

C12H18N2O2 — CID 43754691

IUPAC2-[(4-propan-2-yloxyphenyl)methylamino]acetamide
SMILESCC(C)Oc1ccc(CNCC(N)=O)cc1
InChIInChI=1S/C12H18N2O2/c1-9(2)16-11-5-3-10(4-6-11)7-14-8-12(13)15/h3-6,9,14H,7-8H2,1-2H3,(H2,13,15)
InChIKeyMWSQAJAZKIMDNY-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.05
Rot. Bonds6

About 2-[(4-propan-2-yloxyphenyl)methylamino]acetamide

2-[(4-propan-2-yloxyphenyl)methylamino]acetamide (PubChem CID 43754691) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-[(4-propan-2-yloxyphenyl)methylamino]acetamide.

Molecular Properties

Compound Name2-[(4-propan-2-yloxyphenyl)methylamino]acetamide
PubChem CID43754691
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name2-[(4-propan-2-yloxyphenyl)methylamino]acetamide
SMILESCC(C)Oc1ccc(CNCC(N)=O)cc1
InChIInChI=1S/C12H18N2O2/c1-9(2)16-11-5-3-10(4-6-11)7-14-8-12(13)15/h3-6,9,14H,7-8H2,1-2H3,(H2,13,15)
InChIKeyMWSQAJAZKIMDNY-UHFFFAOYSA-N
XLogP1.05
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(4-propan-2-yloxyphenyl)ethylamino]acetamide
CID 115260110
2-[(4-methoxyphenyl)methylamino]-N-[(4-propan-2-yloxyphenyl)methyl]acetamide
CID 54838126
methyl 2-[(4-propan-2-yloxyphenyl)methylamino]propanoate
CID 60781966
4-[[(4-propan-2-yloxyphenyl)methylamino]methyl]phenol
CID 115581451
N-(1-phenylethyl)-2-[(4-propan-2-yloxyphenyl)methylamino]acetamide
CID 54845447
N-(2,6-dimethylphenyl)-2-[(4-propan-2-yloxyphenyl)methylamino]acetamide
CID 54845330
2-[4-[[(2-amino-2-oxoethyl)amino]methyl]phenoxy]acetic acid
CID 71422873
N-[2-[(4-propan-2-yloxyphenyl)methylamino]ethyl]acetamide
CID 43770338
2-amino-N-[(4-propan-2-yloxyphenyl)methyl]propanamide
CID 115152374
2-[(4-hydroxyphenyl)methylamino]acetamide
CID 16775960
N,N-dimethyl-3-[(4-propan-2-yloxyphenyl)methylamino]propanamide
CID 54935244
N-(2,5-dimethylphenyl)-2-[(4-propan-2-yloxyphenyl)methylamino]acetamide
CID 54845352

Frequently Asked Questions

What is the IUPAC name of 2-[(4-propan-2-yloxyphenyl)methylamino]acetamide?
The IUPAC name of 2-[(4-propan-2-yloxyphenyl)methylamino]acetamide (CID 43754691) is 2-[(4-propan-2-yloxyphenyl)methylamino]acetamide.
What is the SMILES notation for 2-[(4-propan-2-yloxyphenyl)methylamino]acetamide?
The canonical SMILES for 2-[(4-propan-2-yloxyphenyl)methylamino]acetamide is CC(C)Oc1ccc(CNCC(N)=O)cc1.
What is the InChIKey of 2-[(4-propan-2-yloxyphenyl)methylamino]acetamide?
The InChIKey is MWSQAJAZKIMDNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-9(2)16-11-5-3-10(4-6-11)7-14-8-12(13)15/h3-6,9,14H,7-8H2,1-2H3,(H2,13,15).
What are the key properties of 2-[(4-propan-2-yloxyphenyl)methylamino]acetamide?
2-[(4-propan-2-yloxyphenyl)methylamino]acetamide has a molecular weight of 222.29 g/mol, XLogP of 1.05, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-propan-2-yloxyphenyl)methylamino]acetamide is sourced from PubChem (CID 43754691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).