N-(5-chloro-2-ethoxyphenyl)-3-(cyclopropylamino)propanamide

C14H19ClN2O2 — CID 54862719

IUPACN-(5-chloro-2-ethoxyphenyl)-3-(cyclopropylamino)propanamide
SMILESCCOc1ccc(Cl)cc1NC(=O)CCNC1CC1
InChIInChI=1S/C14H19ClN2O2/c1-2-19-13-6-3-10(15)9-12(13)17-14(18)7-8-16-11-4-5-11/h3,6,9,11,16H,2,4-5,7-8H2,1H3,(H,17,18)
InChIKeyRJFKTPYZNROBKW-UHFFFAOYSA-N
MW282.77 g/mol
LogP2.82
Rot. Bonds7

About N-(5-chloro-2-ethoxyphenyl)-3-(cyclopropylamino)propanamide

N-(5-chloro-2-ethoxyphenyl)-3-(cyclopropylamino)propanamide (PubChem CID 54862719) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is N-(5-chloro-2-ethoxyphenyl)-3-(cyclopropylamino)propanamide.

Molecular Properties

Compound NameN-(5-chloro-2-ethoxyphenyl)-3-(cyclopropylamino)propanamide
PubChem CID54862719
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC NameN-(5-chloro-2-ethoxyphenyl)-3-(cyclopropylamino)propanamide
SMILESCCOc1ccc(Cl)cc1NC(=O)CCNC1CC1
InChIInChI=1S/C14H19ClN2O2/c1-2-19-13-6-3-10(15)9-12(13)17-14(18)7-8-16-11-4-5-11/h3,6,9,11,16H,2,4-5,7-8H2,1H3,(H,17,18)
InChIKeyRJFKTPYZNROBKW-UHFFFAOYSA-N
XLogP2.82
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
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-(5-chloro-2-ethoxyphenyl)butanamide
CID 61062519
3-amino-N-(5-chloro-2-ethoxyphenyl)propanamide
CID 60927898
4-chloro-N-(5-chloro-2-ethoxyphenyl)butanamide
CID 63308071
3-(tert-butylamino)-N-(5-chloro-2-ethoxyphenyl)propanamide
CID 60927791
3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide
CID 109013761
3-(cyclopropylamino)-N-(2,4-dichlorophenyl)propanamide
CID 60722944
N-(5-chloro-2-ethoxyphenyl)-2-(cyclopropylmethylamino)acetamide
CID 54862706
N-(5-chloro-2-ethoxyphenyl)-4-hydroxypentanamide
CID 79204145
N-(5-chloro-2-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide
CID 61364064
3-(cyclopropylamino)-N-(2-propoxyphenyl)propanamide
CID 54925076
N-(5-chloro-2-ethoxyphenyl)piperidine-4-carboxamide
CID 54862625
3-amino-N-(5-chloro-2-ethoxyphenyl)-3-methylbutanamide
CID 64683487

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-ethoxyphenyl)-3-(cyclopropylamino)propanamide?
The IUPAC name of N-(5-chloro-2-ethoxyphenyl)-3-(cyclopropylamino)propanamide (CID 54862719) is N-(5-chloro-2-ethoxyphenyl)-3-(cyclopropylamino)propanamide.
What is the SMILES notation for N-(5-chloro-2-ethoxyphenyl)-3-(cyclopropylamino)propanamide?
The canonical SMILES for N-(5-chloro-2-ethoxyphenyl)-3-(cyclopropylamino)propanamide is CCOc1ccc(Cl)cc1NC(=O)CCNC1CC1.
What is the InChIKey of N-(5-chloro-2-ethoxyphenyl)-3-(cyclopropylamino)propanamide?
The InChIKey is RJFKTPYZNROBKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c1-2-19-13-6-3-10(15)9-12(13)17-14(18)7-8-16-11-4-5-11/h3,6,9,11,16H,2,4-5,7-8H2,1H3,(H,17,18).
What are the key properties of N-(5-chloro-2-ethoxyphenyl)-3-(cyclopropylamino)propanamide?
N-(5-chloro-2-ethoxyphenyl)-3-(cyclopropylamino)propanamide has a molecular weight of 282.77 g/mol, XLogP of 2.82, 7 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)-3-(cyclopropylamino)propanamide is sourced from PubChem (CID 54862719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).