5-amino-4-methyl-N-[2-(N-methylanilino)ethyl]pentanamide

C15H25N3O — CID 82012269

IUPAC5-amino-4-methyl-N-[2-(N-methylanilino)ethyl]pentanamide
SMILESCC(CN)CCC(=O)NCCN(C)c1ccccc1
InChIInChI=1S/C15H25N3O/c1-13(12-16)8-9-15(19)17-10-11-18(2)14-6-4-3-5-7-14/h3-7,13H,8-12,16H2,1-2H3,(H,17,19)
InChIKeyUOVYHFDUQLBQSZ-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.61
Rot. Bonds8

About 5-amino-4-methyl-N-[2-(N-methylanilino)ethyl]pentanamide

5-amino-4-methyl-N-[2-(N-methylanilino)ethyl]pentanamide (PubChem CID 82012269) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 5-amino-4-methyl-N-[2-(N-methylanilino)ethyl]pentanamide.

Molecular Properties

Compound Name5-amino-4-methyl-N-[2-(N-methylanilino)ethyl]pentanamide
PubChem CID82012269
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name5-amino-4-methyl-N-[2-(N-methylanilino)ethyl]pentanamide
SMILESCC(CN)CCC(=O)NCCN(C)c1ccccc1
InChIInChI=1S/C15H25N3O/c1-13(12-16)8-9-15(19)17-10-11-18(2)14-6-4-3-5-7-14/h3-7,13H,8-12,16H2,1-2H3,(H,17,19)
InChIKeyUOVYHFDUQLBQSZ-UHFFFAOYSA-N
XLogP1.61
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-amino-4-methyl-N-[2-(N-methylanilino)ethyl]pentanamide?
The IUPAC name of 5-amino-4-methyl-N-[2-(N-methylanilino)ethyl]pentanamide (CID 82012269) is 5-amino-4-methyl-N-[2-(N-methylanilino)ethyl]pentanamide.
What is the SMILES notation for 5-amino-4-methyl-N-[2-(N-methylanilino)ethyl]pentanamide?
The canonical SMILES for 5-amino-4-methyl-N-[2-(N-methylanilino)ethyl]pentanamide is CC(CN)CCC(=O)NCCN(C)c1ccccc1.
What is the InChIKey of 5-amino-4-methyl-N-[2-(N-methylanilino)ethyl]pentanamide?
The InChIKey is UOVYHFDUQLBQSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-13(12-16)8-9-15(19)17-10-11-18(2)14-6-4-3-5-7-14/h3-7,13H,8-12,16H2,1-2H3,(H,17,19).
What are the key properties of 5-amino-4-methyl-N-[2-(N-methylanilino)ethyl]pentanamide?
5-amino-4-methyl-N-[2-(N-methylanilino)ethyl]pentanamide has a molecular weight of 263.38 g/mol, XLogP of 1.61, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-methyl-N-[2-(N-methylanilino)ethyl]pentanamide is sourced from PubChem (CID 82012269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).