N-[2-(2-chloroethoxy)ethyl]-2-cyclobutylacetamide

C10H18ClNO2 — CID 103166701

IUPACN-[2-(2-chloroethoxy)ethyl]-2-cyclobutylacetamide
SMILESO=C(CC1CCC1)NCCOCCCl
InChIInChI=1S/C10H18ClNO2/c11-4-6-14-7-5-12-10(13)8-9-2-1-3-9/h9H,1-8H2,(H,12,13)
InChIKeyNQZJXMNDRMHNIA-UHFFFAOYSA-N
MW219.71 g/mol
LogP1.55
Rot. Bonds7

About N-[2-(2-chloroethoxy)ethyl]-2-cyclobutylacetamide

N-[2-(2-chloroethoxy)ethyl]-2-cyclobutylacetamide (PubChem CID 103166701) has the molecular formula C10H18ClNO2 and a molecular weight of 219.71 g/mol. Its IUPAC name is N-[2-(2-chloroethoxy)ethyl]-2-cyclobutylacetamide.

Molecular Properties

Compound NameN-[2-(2-chloroethoxy)ethyl]-2-cyclobutylacetamide
PubChem CID103166701
Molecular FormulaC10H18ClNO2
Molecular Weight219.71 g/mol
Exact Mass219.10
IUPAC NameN-[2-(2-chloroethoxy)ethyl]-2-cyclobutylacetamide
SMILESO=C(CC1CCC1)NCCOCCCl
InChIInChI=1S/C10H18ClNO2/c11-4-6-14-7-5-12-10(13)8-9-2-1-3-9/h9H,1-8H2,(H,12,13)
InChIKeyNQZJXMNDRMHNIA-UHFFFAOYSA-N
XLogP1.55
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.71
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

N-(2-chloroethyl)-2-cyclobutylacetamide
CID 103164388
2-[2-[(2-cyclohexylacetyl)amino]ethoxy]acetic acid
CID 79457520
2-cyclohexyl-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide
CID 113258414
N-(3-butoxypropyl)-2-cyclopentylacetamide
CID 78785153
2-cyclobutyl-N-[2-[2-[[3-(methylamino)oxiran-2-yl]methoxy]ethoxy]ethyl]acetamide
CID 146648698
2-cyclobutyl-N-(3-hydroxypropyl)acetamide
CID 103799929
3-(2-chloroethoxy)-N-(cyclopentylmethyl)propan-1-amine
CID 106306091
1-[2-(2-chloroethoxy)ethyl]-3-cyclohexylurea
CID 12683643
2-cyclobutyl-N-[2-[2-[(3E)-5-fluoro-2-methylhexa-1,3,5-trien-3-yl]oxyethoxy]ethyl]acetamide;ethane
CID 176700323
N-(3-bromopropyl)-2-cyclobutylacetamide
CID 103164386
N-[2-(2-chloroethoxy)ethyl]-3-methylsulfanylpropanamide
CID 114297749
2-[4-(aminomethyl)cyclohexyl]-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide
CID 63834528

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-chloroethoxy)ethyl]-2-cyclobutylacetamide?
The IUPAC name of N-[2-(2-chloroethoxy)ethyl]-2-cyclobutylacetamide (CID 103166701) is N-[2-(2-chloroethoxy)ethyl]-2-cyclobutylacetamide.
What is the SMILES notation for N-[2-(2-chloroethoxy)ethyl]-2-cyclobutylacetamide?
The canonical SMILES for N-[2-(2-chloroethoxy)ethyl]-2-cyclobutylacetamide is O=C(CC1CCC1)NCCOCCCl.
What is the InChIKey of N-[2-(2-chloroethoxy)ethyl]-2-cyclobutylacetamide?
The InChIKey is NQZJXMNDRMHNIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18ClNO2/c11-4-6-14-7-5-12-10(13)8-9-2-1-3-9/h9H,1-8H2,(H,12,13).
What are the key properties of N-[2-(2-chloroethoxy)ethyl]-2-cyclobutylacetamide?
N-[2-(2-chloroethoxy)ethyl]-2-cyclobutylacetamide has a molecular weight of 219.71 g/mol, XLogP of 1.55, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-chloroethoxy)ethyl]-2-cyclobutylacetamide is sourced from PubChem (CID 103166701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).