N-cyclohexyl-3-(3,5-dichloroanilino)propanamide

C15H20Cl2N2O — CID 109014092

IUPACN-cyclohexyl-3-(3,5-dichloroanilino)propanamide
SMILESO=C(CCNc1cc(Cl)cc(Cl)c1)NC1CCCCC1
InChIInChI=1S/C15H20Cl2N2O/c16-11-8-12(17)10-14(9-11)18-7-6-15(20)19-13-4-2-1-3-5-13/h8-10,13,18H,1-7H2,(H,19,20)
InChIKeyRAVJZKIARRTPGM-UHFFFAOYSA-N
MW315.24 g/mol
LogP4.24
Rot. Bonds5

About N-cyclohexyl-3-(3,5-dichloroanilino)propanamide

N-cyclohexyl-3-(3,5-dichloroanilino)propanamide (PubChem CID 109014092) has the molecular formula C15H20Cl2N2O and a molecular weight of 315.24 g/mol. Its IUPAC name is N-cyclohexyl-3-(3,5-dichloroanilino)propanamide.

Molecular Properties

Compound NameN-cyclohexyl-3-(3,5-dichloroanilino)propanamide
PubChem CID109014092
Molecular FormulaC15H20Cl2N2O
Molecular Weight315.24 g/mol
Exact Mass314.10
IUPAC NameN-cyclohexyl-3-(3,5-dichloroanilino)propanamide
SMILESO=C(CCNc1cc(Cl)cc(Cl)c1)NC1CCCCC1
InChIInChI=1S/C15H20Cl2N2O/c16-11-8-12(17)10-14(9-11)18-7-6-15(20)19-13-4-2-1-3-5-13/h8-10,13,18H,1-7H2,(H,19,20)
InChIKeyRAVJZKIARRTPGM-UHFFFAOYSA-N
XLogP4.24
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.24
LogP ≤ 54.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-(3,5-dichloroanilino)propanamide?
The IUPAC name of N-cyclohexyl-3-(3,5-dichloroanilino)propanamide (CID 109014092) is N-cyclohexyl-3-(3,5-dichloroanilino)propanamide.
What is the SMILES notation for N-cyclohexyl-3-(3,5-dichloroanilino)propanamide?
The canonical SMILES for N-cyclohexyl-3-(3,5-dichloroanilino)propanamide is O=C(CCNc1cc(Cl)cc(Cl)c1)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-3-(3,5-dichloroanilino)propanamide?
The InChIKey is RAVJZKIARRTPGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Cl2N2O/c16-11-8-12(17)10-14(9-11)18-7-6-15(20)19-13-4-2-1-3-5-13/h8-10,13,18H,1-7H2,(H,19,20).
What are the key properties of N-cyclohexyl-3-(3,5-dichloroanilino)propanamide?
N-cyclohexyl-3-(3,5-dichloroanilino)propanamide has a molecular weight of 315.24 g/mol, XLogP of 4.24, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-(3,5-dichloroanilino)propanamide is sourced from PubChem (CID 109014092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).