N-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine

C11H26N2O — CID 106915876

IUPACN-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine
SMILESCNCC(C)CN(C)C(C)CCOC
InChIInChI=1S/C11H26N2O/c1-10(8-12-3)9-13(4)11(2)6-7-14-5/h10-12H,6-9H2,1-5H3
InChIKeyUVFIFSMXWQUFMN-UHFFFAOYSA-N
MW202.34 g/mol
LogP1.20
Rot. Bonds8

About N-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine

N-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine (PubChem CID 106915876) has the molecular formula C11H26N2O and a molecular weight of 202.34 g/mol. Its IUPAC name is N-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine.

Molecular Properties

Compound NameN-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine
PubChem CID106915876
Molecular FormulaC11H26N2O
Molecular Weight202.34 g/mol
Exact Mass202.20
IUPAC NameN-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine
SMILESCNCC(C)CN(C)C(C)CCOC
InChIInChI=1S/C11H26N2O/c1-10(8-12-3)9-13(4)11(2)6-7-14-5/h10-12H,6-9H2,1-5H3
InChIKeyUVFIFSMXWQUFMN-UHFFFAOYSA-N
XLogP1.20
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine 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-(1-methoxypropan-2-yl)-N,N',2-trimethylpropane-1,3-diamine
CID 62429833
ethane;4-methoxy-N-methyl-N-propylbutan-2-amine
CID 153329732
2-N-(2-methoxyethyl)-1-N,2-N-dimethylpropane-1,2-diamine
CID 62447079
N-[3-(2-methoxyethoxy)propyl]-N,N',2-trimethylpropane-1,3-diamine
CID 106915870
1-(methylamino)-3-[methyl(pentan-2-yl)amino]propan-2-ol
CID 43571982
3-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-ylpropane-1,2-diamine
CID 103225752
3-N-(3-methoxypropyl)-1-N,3-N-dimethylbutane-1,3-diamine
CID 63009569
3-methoxy-1-N,2-N-dimethyl-2-N-(3-methylbutyl)propane-1,2-diamine
CID 103226184
4-N-(3-methoxypropyl)-1-N,4-N-dimethylpentane-1,4-diamine
CID 63007950
methyl 2-[4-methoxybutan-2-yl(methyl)amino]acetate
CID 115688695
2-N-(2-methoxyethyl)-1-N-methyl-2-N-(2-methylpropyl)propane-1,2-diamine
CID 62428889
1-N-butan-2-yl-4-methoxy-1-N-methylbutane-1,2-diamine
CID 62475612

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine?
The IUPAC name of N-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine (CID 106915876) is N-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine.
What is the SMILES notation for N-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine?
The canonical SMILES for N-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine is CNCC(C)CN(C)C(C)CCOC.
What is the InChIKey of N-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine?
The InChIKey is UVFIFSMXWQUFMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O/c1-10(8-12-3)9-13(4)11(2)6-7-14-5/h10-12H,6-9H2,1-5H3.
What are the key properties of N-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine?
N-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine has a molecular weight of 202.34 g/mol, XLogP of 1.20, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine is sourced from PubChem (CID 106915876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).