N-(5-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide

C14H19ClN2O2 — CID 61364064

IUPACN-(5-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide
SMILESCCOc1ccc(Cl)cc1NC(=O)CC1CCCN1
InChIInChI=1S/C14H19ClN2O2/c1-2-19-13-6-5-10(15)8-12(13)17-14(18)9-11-4-3-7-16-11/h5-6,8,11,16H,2-4,7,9H2,1H3,(H,17,18)
InChIKeyHBOHQWDBVSUZGY-UHFFFAOYSA-N
MW282.77 g/mol
LogP2.82
Rot. Bonds5

About N-(5-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide

N-(5-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide (PubChem CID 61364064) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is N-(5-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-(5-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide
PubChem CID61364064
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC NameN-(5-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide
SMILESCCOc1ccc(Cl)cc1NC(=O)CC1CCCN1
InChIInChI=1S/C14H19ClN2O2/c1-2-19-13-6-5-10(15)8-12(13)17-14(18)9-11-4-3-7-16-11/h5-6,8,11,16H,2-4,7,9H2,1H3,(H,17,18)
InChIKeyHBOHQWDBVSUZGY-UHFFFAOYSA-N
XLogP2.82
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide
CID 119808246
N-(4-bromo-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide
CID 119812519
N-(2-bromo-5-chlorophenyl)-2-pyrrolidin-2-ylacetamide
CID 81270551
N-(5-chloro-2-ethoxyphenyl)-2-(cyclopropylmethylamino)acetamide
CID 54862706
5-chloro-N-ethyl-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide
CID 119770135
5-chloro-2-[(2-pyrrolidin-2-ylacetyl)amino]benzoic acid
CID 61365655
N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119683547
N-[5-fluoro-2-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide
CID 119756535
N-[5-chloro-2-(2-ethoxyethoxy)phenyl]-2-thiomorpholin-3-ylacetamide;hydrochloride
CID 119938692
N-(5-chloro-2-ethoxyphenyl)piperidine-4-carboxamide
CID 54862625
N-(5-chloro-2-ethoxyphenyl)-3-(cyclopropylamino)propanamide
CID 54862719
N-(5-chloro-2-ethoxyphenyl)butanamide
CID 61062519

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-(5-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide (CID 61364064) is N-(5-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-(5-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-(5-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide is CCOc1ccc(Cl)cc1NC(=O)CC1CCCN1.
What is the InChIKey of N-(5-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide?
The InChIKey is HBOHQWDBVSUZGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c1-2-19-13-6-5-10(15)8-12(13)17-14(18)9-11-4-3-7-16-11/h5-6,8,11,16H,2-4,7,9H2,1H3,(H,17,18).
What are the key properties of N-(5-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide?
N-(5-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide has a molecular weight of 282.77 g/mol, XLogP of 2.82, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 61364064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).