N-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide

C12H23NO2 — CID 103164593

IUPACN-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide
SMILESCCOC1CC(CC(=O)NC(C)CC)C1
InChIInChI=1S/C12H23NO2/c1-4-9(3)13-12(14)8-10-6-11(7-10)15-5-2/h9-11H,4-8H2,1-3H3,(H,13,14)
InChIKeyBLHYBOICCYXTJK-UHFFFAOYSA-N
MW213.32 g/mol
LogP2.11
Rot. Bonds6

About N-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide

N-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide (PubChem CID 103164593) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is N-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide.

Molecular Properties

Compound NameN-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide
PubChem CID103164593
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC NameN-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide
SMILESCCOC1CC(CC(=O)NC(C)CC)C1
InChIInChI=1S/C12H23NO2/c1-4-9(3)13-12(14)8-10-6-11(7-10)15-5-2/h9-11H,4-8H2,1-3H3,(H,13,14)
InChIKeyBLHYBOICCYXTJK-UHFFFAOYSA-N
XLogP2.11
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-ethoxycyclobutyl)-N-[(2S)-1-hydroxypropan-2-yl]acetamide
CID 103164701
N-(1-aminopropan-2-yl)-2-(3-ethoxycyclobutyl)acetamide
CID 103164943
N-(4-chloropentan-2-yl)-2-(3-ethoxycyclobutyl)acetamide
CID 103166851
2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide
CID 103512576
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-butan-2-ylacetamide
CID 79608095
3-[[2-(3-ethoxycyclobutyl)acetyl]amino]-4,4-dimethylpentanoic acid
CID 103162128
N-(1-chloro-4,4-dimethylpentan-3-yl)-2-(3-ethoxycyclobutyl)acetamide
CID 106355819
2-[[2-(3-ethoxycyclobutyl)acetyl]amino]acetic acid
CID 103161702
(2R)-2-[[2-(3-ethoxycyclobutyl)acetyl]amino]hexanedioic acid
CID 107831676
N-(2-bromo-4-methylpentyl)-2-(3-ethoxycyclobutyl)acetamide
CID 107157895
2-(3-ethoxycyclobutyl)-N-(3-hydroxycyclobutyl)acetamide
CID 103164715
N-butan-2-yl-2-(1,1-dioxothian-4-yl)acetamide
CID 110848488

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide?
The IUPAC name of N-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide (CID 103164593) is N-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide.
What is the SMILES notation for N-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide?
The canonical SMILES for N-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide is CCOC1CC(CC(=O)NC(C)CC)C1.
What is the InChIKey of N-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide?
The InChIKey is BLHYBOICCYXTJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-4-9(3)13-12(14)8-10-6-11(7-10)15-5-2/h9-11H,4-8H2,1-3H3,(H,13,14).
What are the key properties of N-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide?
N-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide has a molecular weight of 213.32 g/mol, XLogP of 2.11, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide is sourced from PubChem (CID 103164593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).