4-(2-chlorophenyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]butanamide

C19H20Cl2N2O2 — CID 110625400

IUPAC4-(2-chlorophenyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]butanamide
SMILESO=C(CCCc1ccccc1Cl)NCC(=O)NCc1ccc(Cl)cc1
InChIInChI=1S/C19H20Cl2N2O2/c20-16-10-8-14(9-11-16)12-22-19(25)13-23-18(24)7-3-5-15-4-1-2-6-17(15)21/h1-2,4,6,8-11H,3,5,7,12-13H2,(H,22,25)(H,23,24)
InChIKeyBQICTIKLEOGPGK-UHFFFAOYSA-N
MW379.29 g/mol
LogP3.75
Rot. Bonds8

About 4-(2-chlorophenyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]butanamide

4-(2-chlorophenyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]butanamide (PubChem CID 110625400) has the molecular formula C19H20Cl2N2O2 and a molecular weight of 379.29 g/mol. Its IUPAC name is 4-(2-chlorophenyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]butanamide.

Molecular Properties

Compound Name4-(2-chlorophenyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]butanamide
PubChem CID110625400
Molecular FormulaC19H20Cl2N2O2
Molecular Weight379.29 g/mol
Exact Mass378.09
IUPAC Name4-(2-chlorophenyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]butanamide
SMILESO=C(CCCc1ccccc1Cl)NCC(=O)NCc1ccc(Cl)cc1
InChIInChI=1S/C19H20Cl2N2O2/c20-16-10-8-14(9-11-16)12-22-19(25)13-23-18(24)7-3-5-15-4-1-2-6-17(15)21/h1-2,4,6,8-11H,3,5,7,12-13H2,(H,22,25)(H,23,24)
InChIKeyBQICTIKLEOGPGK-UHFFFAOYSA-N
XLogP3.75
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.29
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-4-phenoxybutanamide
CID 110285273
N-[(4-chlorophenyl)methyl]-4-(1H-indol-3-yl)butanamide
CID 2114507
3-(2-chlorophenyl)-N-[(4-methylphenyl)methyl]propanamide
CID 38089852
N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-2-(2-methylphenyl)acetamide
CID 112992693
N-benzyl-4-[2-[3-(2-chlorophenyl)propanoyl]hydrazinyl]-4-oxobutanamide
CID 17179143
N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-5-(4-methoxyphenyl)pentanamide
CID 110305545
4-amino-N-[(2-chlorophenyl)methyl]butanamide
CID 22692149
4-amino-N-[2-(benzylamino)-2-oxoethyl]butanamide
CID 54881613
N-[3-(2-chlorophenyl)propyl]-3-(2,4-dichlorophenyl)propanamide
CID 100608161
4-(4-chlorophenyl)-N-[(2-methoxyphenyl)methyl]butanamide
CID 110297627
4-(2-chlorophenyl)-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]butanamide
CID 110614657
2-(4-bromophenyl)-N-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]acetamide
CID 112992648

Frequently Asked Questions

What is the IUPAC name of 4-(2-chlorophenyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]butanamide?
The IUPAC name of 4-(2-chlorophenyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]butanamide (CID 110625400) is 4-(2-chlorophenyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]butanamide.
What is the SMILES notation for 4-(2-chlorophenyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]butanamide?
The canonical SMILES for 4-(2-chlorophenyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]butanamide is O=C(CCCc1ccccc1Cl)NCC(=O)NCc1ccc(Cl)cc1.
What is the InChIKey of 4-(2-chlorophenyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]butanamide?
The InChIKey is BQICTIKLEOGPGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20Cl2N2O2/c20-16-10-8-14(9-11-16)12-22-19(25)13-23-18(24)7-3-5-15-4-1-2-6-17(15)21/h1-2,4,6,8-11H,3,5,7,12-13H2,(H,22,25)(H,23,24).
What are the key properties of 4-(2-chlorophenyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]butanamide?
4-(2-chlorophenyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]butanamide has a molecular weight of 379.29 g/mol, XLogP of 3.75, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chlorophenyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]butanamide is sourced from PubChem (CID 110625400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).