N-(4-amino-2,2,4-trimethylpentyl)-3-methoxy-2,2-dimethylpropanamide

C14H30N2O2 — CID 146259468

IUPACN-(4-amino-2,2,4-trimethylpentyl)-3-methoxy-2,2-dimethylpropanamide
SMILESCOCC(C)(C)C(=O)NCC(C)(C)CC(C)(C)N
InChIInChI=1S/C14H30N2O2/c1-12(2,8-14(5,6)15)9-16-11(17)13(3,4)10-18-7/h8-10,15H2,1-7H3,(H,16,17)
InChIKeyGMXJNLLJAPDNBC-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.93
Rot. Bonds7

About N-(4-amino-2,2,4-trimethylpentyl)-3-methoxy-2,2-dimethylpropanamide

N-(4-amino-2,2,4-trimethylpentyl)-3-methoxy-2,2-dimethylpropanamide (PubChem CID 146259468) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is N-(4-amino-2,2,4-trimethylpentyl)-3-methoxy-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(4-amino-2,2,4-trimethylpentyl)-3-methoxy-2,2-dimethylpropanamide
PubChem CID146259468
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC NameN-(4-amino-2,2,4-trimethylpentyl)-3-methoxy-2,2-dimethylpropanamide
SMILESCOCC(C)(C)C(=O)NCC(C)(C)CC(C)(C)N
InChIInChI=1S/C14H30N2O2/c1-12(2,8-14(5,6)15)9-16-11(17)13(3,4)10-18-7/h8-10,15H2,1-7H3,(H,16,17)
InChIKeyGMXJNLLJAPDNBC-UHFFFAOYSA-N
XLogP1.93
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(4-amino-2,2,4-trimethylpentyl)-3-methoxy-2,2-dimethylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2,2,4-trimethylpentyl)-3-methoxy-2,2-dimethylpropanamide?
The IUPAC name of N-(4-amino-2,2,4-trimethylpentyl)-3-methoxy-2,2-dimethylpropanamide (CID 146259468) is N-(4-amino-2,2,4-trimethylpentyl)-3-methoxy-2,2-dimethylpropanamide.
What is the SMILES notation for N-(4-amino-2,2,4-trimethylpentyl)-3-methoxy-2,2-dimethylpropanamide?
The canonical SMILES for N-(4-amino-2,2,4-trimethylpentyl)-3-methoxy-2,2-dimethylpropanamide is COCC(C)(C)C(=O)NCC(C)(C)CC(C)(C)N.
What is the InChIKey of N-(4-amino-2,2,4-trimethylpentyl)-3-methoxy-2,2-dimethylpropanamide?
The InChIKey is GMXJNLLJAPDNBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-12(2,8-14(5,6)15)9-16-11(17)13(3,4)10-18-7/h8-10,15H2,1-7H3,(H,16,17).
What are the key properties of N-(4-amino-2,2,4-trimethylpentyl)-3-methoxy-2,2-dimethylpropanamide?
N-(4-amino-2,2,4-trimethylpentyl)-3-methoxy-2,2-dimethylpropanamide has a molecular weight of 258.41 g/mol, XLogP of 1.93, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2,2,4-trimethylpentyl)-3-methoxy-2,2-dimethylpropanamide is sourced from PubChem (CID 146259468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).