N-[2-(N-(3-methoxyphenyl)anilino)ethyl]butanamide

C19H24N2O2 — CID 24750071

IUPACN-[2-(N-(3-methoxyphenyl)anilino)ethyl]butanamide
SMILESCCCC(=O)NCCN(c1ccccc1)c1cccc(OC)c1
InChIInChI=1S/C19H24N2O2/c1-3-8-19(22)20-13-14-21(16-9-5-4-6-10-16)17-11-7-12-18(15-17)23-2/h4-7,9-12,15H,3,8,13-14H2,1-2H3,(H,20,22)
InChIKeyMBOGNCNDFYBDJC-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.75
Rot. Bonds8

About N-[2-(N-(3-methoxyphenyl)anilino)ethyl]butanamide

N-[2-(N-(3-methoxyphenyl)anilino)ethyl]butanamide (PubChem CID 24750071) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is N-[2-(N-(3-methoxyphenyl)anilino)ethyl]butanamide.

Molecular Properties

Compound NameN-[2-(N-(3-methoxyphenyl)anilino)ethyl]butanamide
PubChem CID24750071
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC NameN-[2-(N-(3-methoxyphenyl)anilino)ethyl]butanamide
SMILESCCCC(=O)NCCN(c1ccccc1)c1cccc(OC)c1
InChIInChI=1S/C19H24N2O2/c1-3-8-19(22)20-13-14-21(16-9-5-4-6-10-16)17-11-7-12-18(15-17)23-2/h4-7,9-12,15H,3,8,13-14H2,1-2H3,(H,20,22)
InChIKeyMBOGNCNDFYBDJC-UHFFFAOYSA-N
XLogP3.75
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(N-acetyl-3-methoxyanilino)ethyl]butanamide
CID 113060528
N-[2-(N-(3-methoxyphenyl)anilino)ethyl]cyclobutanecarboxamide
CID 24750194
N-[2-(3-methoxy-N-methylsulfonylanilino)ethyl]pentanamide
CID 113070417
3-(N-ethylanilino)-N-[2-(3-methoxyphenyl)ethyl]propanamide
CID 109025532
N-[2-(3-methoxy-N-methylsulfonylanilino)ethyl]-2-phenoxyacetamide
CID 113070442
N-[2-(3-methoxyphenyl)ethyl]-3-(N-methylsulfonylanilino)propanamide
CID 113141472
3-(N-acetyl-3-methoxyanilino)-N-[3-(dimethylamino)propyl]propanamide
CID 113128887
N-[3-(N-ethylanilino)propyl]-2-(3-methoxyphenyl)acetamide
CID 18118732
N-[2-(3-methoxyphenoxy)ethyl]-3-phenoxypropanamide
CID 113099798
N-[2-(dimethylamino)ethyl]-4-(3-methoxyphenoxy)butanamide
CID 110486942
N-[2-(N-acetyl-2,5-dimethoxyanilino)ethyl]butanamide
CID 113061147
N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]butanamide
CID 112510090

Frequently Asked Questions

What is the IUPAC name of N-[2-(N-(3-methoxyphenyl)anilino)ethyl]butanamide?
The IUPAC name of N-[2-(N-(3-methoxyphenyl)anilino)ethyl]butanamide (CID 24750071) is N-[2-(N-(3-methoxyphenyl)anilino)ethyl]butanamide.
What is the SMILES notation for N-[2-(N-(3-methoxyphenyl)anilino)ethyl]butanamide?
The canonical SMILES for N-[2-(N-(3-methoxyphenyl)anilino)ethyl]butanamide is CCCC(=O)NCCN(c1ccccc1)c1cccc(OC)c1.
What is the InChIKey of N-[2-(N-(3-methoxyphenyl)anilino)ethyl]butanamide?
The InChIKey is MBOGNCNDFYBDJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-3-8-19(22)20-13-14-21(16-9-5-4-6-10-16)17-11-7-12-18(15-17)23-2/h4-7,9-12,15H,3,8,13-14H2,1-2H3,(H,20,22).
What are the key properties of N-[2-(N-(3-methoxyphenyl)anilino)ethyl]butanamide?
N-[2-(N-(3-methoxyphenyl)anilino)ethyl]butanamide has a molecular weight of 312.41 g/mol, XLogP of 3.75, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(N-(3-methoxyphenyl)anilino)ethyl]butanamide is sourced from PubChem (CID 24750071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).