N-[3-(aminomethoxy)-3-methylbutyl]-4-methylpentanamide

C12H26N2O2 — CID 138462196

IUPACN-[3-(aminomethoxy)-3-methylbutyl]-4-methylpentanamide
SMILESCC(C)CCC(=O)NCCC(C)(C)OCN
InChIInChI=1S/C12H26N2O2/c1-10(2)5-6-11(15)14-8-7-12(3,4)16-9-13/h10H,5-9,13H2,1-4H3,(H,14,15)
InChIKeyNSWHYKPDMLOASZ-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.64
Rot. Bonds8

About N-[3-(aminomethoxy)-3-methylbutyl]-4-methylpentanamide

N-[3-(aminomethoxy)-3-methylbutyl]-4-methylpentanamide (PubChem CID 138462196) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-[3-(aminomethoxy)-3-methylbutyl]-4-methylpentanamide.

Molecular Properties

Compound NameN-[3-(aminomethoxy)-3-methylbutyl]-4-methylpentanamide
PubChem CID138462196
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC NameN-[3-(aminomethoxy)-3-methylbutyl]-4-methylpentanamide
SMILESCC(C)CCC(=O)NCCC(C)(C)OCN
InChIInChI=1S/C12H26N2O2/c1-10(2)5-6-11(15)14-8-7-12(3,4)16-9-13/h10H,5-9,13H2,1-4H3,(H,14,15)
InChIKeyNSWHYKPDMLOASZ-UHFFFAOYSA-N
XLogP1.64
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze N-[3-(aminomethoxy)-3-methylbutyl]-4-methylpentanamide with MolForge

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

Launch Full Analysis

Related Compounds

N-[3-methyl-3-(3-methylbutoxy)butyl]propanamide
CID 147929425
methanamine;N-[3-methyl-3-(3-methylbutoxy)butyl]acetamide
CID 156868708
4,4-dimethyl-N-(3-methylbutyl)pentanamide
CID 135139773
4-[(3-ethoxy-3-methylbutyl)amino]-4-oxobutanoic acid
CID 121263526
N-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-4-methylpentanamide
CID 162756086
6-amino-4,4-dimethyl-N-(7-methyloctyl)hexanamide
CID 65292309
N-[3-(aminomethoxy)-3-methylbutyl]-3-(3-methylsulfanyl-2,5-dioxopyrrolidin-1-yl)propanamide
CID 130471010
4,4-dimethyl-N-(3-methylbutyl)hexanamide
CID 162526519
N-[3-[3-(ethylamino)-3-oxopropoxy]-3-methylbutyl]butanamide
CID 146942531
3-octadecoxypropyl N-[6-[[3-methyl-3-(3-methylbutoxy)butyl]amino]-6-oxohexyl]carbamate
CID 88586333
4-methyl-N-[3-[[3-[[3-[5-[3-[3-[3-(4-methylpentanoylamino)propanoylamino]propanoylamino]propanoylamino]pentylamino]-3-oxopropyl]amino]-3-oxopropyl]amino]-3-oxopropyl]pentanamide
CID 59046039
4-methyl-N-(6-methylheptyl)pentanamide
CID 129055781

Frequently Asked Questions

What is the IUPAC name of N-[3-(aminomethoxy)-3-methylbutyl]-4-methylpentanamide?
The IUPAC name of N-[3-(aminomethoxy)-3-methylbutyl]-4-methylpentanamide (CID 138462196) is N-[3-(aminomethoxy)-3-methylbutyl]-4-methylpentanamide.
What is the SMILES notation for N-[3-(aminomethoxy)-3-methylbutyl]-4-methylpentanamide?
The canonical SMILES for N-[3-(aminomethoxy)-3-methylbutyl]-4-methylpentanamide is CC(C)CCC(=O)NCCC(C)(C)OCN.
What is the InChIKey of N-[3-(aminomethoxy)-3-methylbutyl]-4-methylpentanamide?
The InChIKey is NSWHYKPDMLOASZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-10(2)5-6-11(15)14-8-7-12(3,4)16-9-13/h10H,5-9,13H2,1-4H3,(H,14,15).
What are the key properties of N-[3-(aminomethoxy)-3-methylbutyl]-4-methylpentanamide?
N-[3-(aminomethoxy)-3-methylbutyl]-4-methylpentanamide has a molecular weight of 230.35 g/mol, XLogP of 1.64, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(aminomethoxy)-3-methylbutyl]-4-methylpentanamide is sourced from PubChem (CID 138462196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).