ethane;5-methoxy-N,N,4-trimethylpentan-1-amine

C11H27NO — CID 143609953

IUPACethane;5-methoxy-N,N,4-trimethylpentan-1-amine
SMILESCC.COCC(C)CCCN(C)C
InChIInChI=1S/C9H21NO.C2H6/c1-9(8-11-4)6-5-7-10(2)3;1-2/h9H,5-8H2,1-4H3;1-2H3
InChIKeyCUZSCBUKRLWGHI-UHFFFAOYSA-N
MW189.34 g/mol
LogP2.64
Rot. Bonds6

About ethane;5-methoxy-N,N,4-trimethylpentan-1-amine

ethane;5-methoxy-N,N,4-trimethylpentan-1-amine (PubChem CID 143609953) has the molecular formula C11H27NO and a molecular weight of 189.34 g/mol. Its IUPAC name is ethane;5-methoxy-N,N,4-trimethylpentan-1-amine.

Molecular Properties

Compound Nameethane;5-methoxy-N,N,4-trimethylpentan-1-amine
PubChem CID143609953
Molecular FormulaC11H27NO
Molecular Weight189.34 g/mol
Exact Mass189.21
IUPAC Nameethane;5-methoxy-N,N,4-trimethylpentan-1-amine
SMILESCC.COCC(C)CCCN(C)C
InChIInChI=1S/C9H21NO.C2H6/c1-9(8-11-4)6-5-7-10(2)3;1-2/h9H,5-8H2,1-4H3;1-2H3
InChIKeyCUZSCBUKRLWGHI-UHFFFAOYSA-N
XLogP2.64
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.34
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze ethane;5-methoxy-N,N,4-trimethylpentan-1-amine 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

4-bromo-1-methoxy-2-methylbutane
CID 115625046
1,11-dimethoxy-2-methylundecane
CID 118982395
N',N'-bis(2-methoxyethyl)-2-methylpentane-1,5-diamine
CID 82683899
1-methoxy-2,22-dimethyltetracosane
CID 86173032
N,N,N',N',2-pentamethylhexane-1,6-diamine
CID 161408283
1-methoxy-2-methyldecane
CID 13444249
5-methoxy-N,N-dimethyl-4-phenylpentan-1-amine
CID 171986460
4-[3-(dimethylamino)propyl]-N,N,N',N'-tetramethylheptane-1,7-diamine
CID 58251491
(3S)-4-methoxy-3-methylbutan-1-ol
CID 87593216
N'-[3-(dimethylamino)propyl]-N',2-dimethylpentane-1,5-diamine
CID 82017008
1-methoxy-2,12-dimethyldocosane
CID 91752253
4-(dimethylamino)-1-methoxybutan-2-ol
CID 115345876

Frequently Asked Questions

What is the IUPAC name of ethane;5-methoxy-N,N,4-trimethylpentan-1-amine?
The IUPAC name of ethane;5-methoxy-N,N,4-trimethylpentan-1-amine (CID 143609953) is ethane;5-methoxy-N,N,4-trimethylpentan-1-amine.
What is the SMILES notation for ethane;5-methoxy-N,N,4-trimethylpentan-1-amine?
The canonical SMILES for ethane;5-methoxy-N,N,4-trimethylpentan-1-amine is CC.COCC(C)CCCN(C)C.
What is the InChIKey of ethane;5-methoxy-N,N,4-trimethylpentan-1-amine?
The InChIKey is CUZSCBUKRLWGHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO.C2H6/c1-9(8-11-4)6-5-7-10(2)3;1-2/h9H,5-8H2,1-4H3;1-2H3.
What are the key properties of ethane;5-methoxy-N,N,4-trimethylpentan-1-amine?
ethane;5-methoxy-N,N,4-trimethylpentan-1-amine has a molecular weight of 189.34 g/mol, XLogP of 2.64, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-methoxy-N,N,4-trimethylpentan-1-amine is sourced from PubChem (CID 143609953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).