3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide

C14H18Cl2N2O — CID 109013761

IUPAC3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide
SMILESO=C(CCNC1CCCC1)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C14H18Cl2N2O/c15-10-5-6-12(16)13(9-10)18-14(19)7-8-17-11-3-1-2-4-11/h5-6,9,11,17H,1-4,7-8H2,(H,18,19)
InChIKeyZCCHEBINUPQTNZ-UHFFFAOYSA-N
MW301.22 g/mol
LogP3.85
Rot. Bonds5

About 3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide

3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide (PubChem CID 109013761) has the molecular formula C14H18Cl2N2O and a molecular weight of 301.22 g/mol. Its IUPAC name is 3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide.

Molecular Properties

Compound Name3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide
PubChem CID109013761
Molecular FormulaC14H18Cl2N2O
Molecular Weight301.22 g/mol
Exact Mass300.08
IUPAC Name3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide
SMILESO=C(CCNC1CCCC1)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C14H18Cl2N2O/c15-10-5-6-12(16)13(9-10)18-14(19)7-8-17-11-3-1-2-4-11/h5-6,9,11,17H,1-4,7-8H2,(H,18,19)
InChIKeyZCCHEBINUPQTNZ-UHFFFAOYSA-N
XLogP3.85
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.22
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(cyclopropylamino)-N-(2,4-dichlorophenyl)propanamide
CID 60722944
N-(4-chlorophenyl)-3-(cyclopentylamino)propanamide
CID 109013697
N-(5-chloro-2-ethoxyphenyl)-3-(cyclopropylamino)propanamide
CID 54862719
3-(cycloheptylamino)-N-(3,5-dichlorophenyl)propanamide
CID 109031654
3-cyclohexylsulfanyl-N-(2,5-dichlorophenyl)propanamide
CID 23804460
2-cyclopentyl-N-(2,5-dichlorophenyl)acetamide
CID 7733768
3-(cyclopentylamino)-N-(2,3,4-trifluorophenyl)propanamide
CID 109013773
1-cyclopentyl-3-(2,5-dichlorophenyl)urea
CID 47192576
2-cyclopropyl-2-[[3-(2,5-dichloroanilino)-3-oxopropyl]amino]acetic acid
CID 62695617
2-(cyclopentylamino)-N-(2,4-dichlorophenyl)acetamide
CID 9465920
N-(2,5-dichlorophenyl)-3-hydroxypropanamide
CID 43558723
3-[(4-chlorophenyl)methylamino]-N-(2,5-dichlorophenyl)propanamide
CID 109021928

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide?
The IUPAC name of 3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide (CID 109013761) is 3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide.
What is the SMILES notation for 3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide?
The canonical SMILES for 3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide is O=C(CCNC1CCCC1)Nc1cc(Cl)ccc1Cl.
What is the InChIKey of 3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide?
The InChIKey is ZCCHEBINUPQTNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18Cl2N2O/c15-10-5-6-12(16)13(9-10)18-14(19)7-8-17-11-3-1-2-4-11/h5-6,9,11,17H,1-4,7-8H2,(H,18,19).
What are the key properties of 3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide?
3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide has a molecular weight of 301.22 g/mol, XLogP of 3.85, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide is sourced from PubChem (CID 109013761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).