N-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2,5-dichlorophenyl)acetamide

C17H23Cl2N3O2 — CID 113063693

IUPACN-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2,5-dichlorophenyl)acetamide
SMILESCC(=O)N(CCNC(=O)NC1CCCCC1)c1cc(Cl)ccc1Cl
InChIInChI=1S/C17H23Cl2N3O2/c1-12(23)22(16-11-13(18)7-8-15(16)19)10-9-20-17(24)21-14-5-3-2-4-6-14/h7-8,11,14H,2-6,9-10H2,1H3,(H2,20,21,24)
InChIKeySNAZXAPTHDFEKS-UHFFFAOYSA-N
MW372.30 g/mol
LogP3.98
Rot. Bonds5

About N-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2,5-dichlorophenyl)acetamide

N-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2,5-dichlorophenyl)acetamide (PubChem CID 113063693) has the molecular formula C17H23Cl2N3O2 and a molecular weight of 372.30 g/mol. Its IUPAC name is N-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2,5-dichlorophenyl)acetamide.

Molecular Properties

Compound NameN-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2,5-dichlorophenyl)acetamide
PubChem CID113063693
Molecular FormulaC17H23Cl2N3O2
Molecular Weight372.30 g/mol
Exact Mass371.12
IUPAC NameN-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2,5-dichlorophenyl)acetamide
SMILESCC(=O)N(CCNC(=O)NC1CCCCC1)c1cc(Cl)ccc1Cl
InChIInChI=1S/C17H23Cl2N3O2/c1-12(23)22(16-11-13(18)7-8-15(16)19)10-9-20-17(24)21-14-5-3-2-4-6-14/h7-8,11,14H,2-6,9-10H2,1H3,(H2,20,21,24)
InChIKeySNAZXAPTHDFEKS-UHFFFAOYSA-N
XLogP3.98
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.30
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-chloro-2-methoxyphenyl)-N-[2-(cyclopropylcarbamoylamino)ethyl]acetamide
CID 113060320
N-[2-(cyclohexylcarbamoylamino)ethyl]-N-phenylacetamide
CID 113057217
N-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2-ethoxyphenyl)acetamide
CID 113060789
N-(4-acetylphenyl)-N-[2-(cyclohexylcarbamoylamino)ethyl]acetamide
CID 113061686
N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2,4-difluorophenyl)acetamide
CID 113063349
N-[(2-chlorophenyl)methyl]-N-[2-(cyclohexylcarbamoylamino)ethyl]acetamide
CID 113054788
N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide
CID 113058350
3-[acetyl-[2-(2,4-dichlorophenyl)ethyl]amino]-N-cycloheptylpropanamide
CID 113123314
N-(4-bromo-2-methylphenyl)-N-[2-(cyclopropylcarbamoylamino)ethyl]acetamide
CID 113062891
1-[2-(5-chloro-2-methylphenoxy)ethyl]-3-cyclohexylurea
CID 70796637
1-cyclohexyl-3-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethyl]urea
CID 100744347
N-[2-(cyclohexylcarbamoylamino)ethyl]-N-[2-(2-fluorophenyl)ethyl]acetamide
CID 113055684

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2,5-dichlorophenyl)acetamide?
The IUPAC name of N-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2,5-dichlorophenyl)acetamide (CID 113063693) is N-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2,5-dichlorophenyl)acetamide.
What is the SMILES notation for N-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2,5-dichlorophenyl)acetamide?
The canonical SMILES for N-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2,5-dichlorophenyl)acetamide is CC(=O)N(CCNC(=O)NC1CCCCC1)c1cc(Cl)ccc1Cl.
What is the InChIKey of N-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2,5-dichlorophenyl)acetamide?
The InChIKey is SNAZXAPTHDFEKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23Cl2N3O2/c1-12(23)22(16-11-13(18)7-8-15(16)19)10-9-20-17(24)21-14-5-3-2-4-6-14/h7-8,11,14H,2-6,9-10H2,1H3,(H2,20,21,24).
What are the key properties of N-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2,5-dichlorophenyl)acetamide?
N-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2,5-dichlorophenyl)acetamide has a molecular weight of 372.30 g/mol, XLogP of 3.98, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2,5-dichlorophenyl)acetamide is sourced from PubChem (CID 113063693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).