2-[4-(ethylamino)-2-propan-2-yloxan-4-yl]acetamide

C12H24N2O2 — CID 65233958

IUPAC2-[4-(ethylamino)-2-propan-2-yloxan-4-yl]acetamide
SMILESCCNC1(CC(N)=O)CCOC(C(C)C)C1
InChIInChI=1S/C12H24N2O2/c1-4-14-12(8-11(13)15)5-6-16-10(7-12)9(2)3/h9-10,14H,4-8H2,1-3H3,(H2,13,15)
InChIKeyBMVBBIWEBJNPHK-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.05
Rot. Bonds5

About 2-[4-(ethylamino)-2-propan-2-yloxan-4-yl]acetamide

2-[4-(ethylamino)-2-propan-2-yloxan-4-yl]acetamide (PubChem CID 65233958) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-[4-(ethylamino)-2-propan-2-yloxan-4-yl]acetamide.

Molecular Properties

Compound Name2-[4-(ethylamino)-2-propan-2-yloxan-4-yl]acetamide
PubChem CID65233958
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-[4-(ethylamino)-2-propan-2-yloxan-4-yl]acetamide
SMILESCCNC1(CC(N)=O)CCOC(C(C)C)C1
InChIInChI=1S/C12H24N2O2/c1-4-14-12(8-11(13)15)5-6-16-10(7-12)9(2)3/h9-10,14H,4-8H2,1-3H3,(H2,13,15)
InChIKeyBMVBBIWEBJNPHK-UHFFFAOYSA-N
XLogP1.05
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(ethylamino)-2-propan-2-yloxan-4-yl]acetamide?
The IUPAC name of 2-[4-(ethylamino)-2-propan-2-yloxan-4-yl]acetamide (CID 65233958) is 2-[4-(ethylamino)-2-propan-2-yloxan-4-yl]acetamide.
What is the SMILES notation for 2-[4-(ethylamino)-2-propan-2-yloxan-4-yl]acetamide?
The canonical SMILES for 2-[4-(ethylamino)-2-propan-2-yloxan-4-yl]acetamide is CCNC1(CC(N)=O)CCOC(C(C)C)C1.
What is the InChIKey of 2-[4-(ethylamino)-2-propan-2-yloxan-4-yl]acetamide?
The InChIKey is BMVBBIWEBJNPHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-4-14-12(8-11(13)15)5-6-16-10(7-12)9(2)3/h9-10,14H,4-8H2,1-3H3,(H2,13,15).
What are the key properties of 2-[4-(ethylamino)-2-propan-2-yloxan-4-yl]acetamide?
2-[4-(ethylamino)-2-propan-2-yloxan-4-yl]acetamide has a molecular weight of 228.34 g/mol, XLogP of 1.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(ethylamino)-2-propan-2-yloxan-4-yl]acetamide is sourced from PubChem (CID 65233958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).