ethane;N-ethyl-1-methoxy-2-methylpropan-2-amine

C9H23NO — CID 177317291

IUPACethane;N-ethyl-1-methoxy-2-methylpropan-2-amine
SMILESCC.CCNC(C)(C)COC
InChIInChI=1S/C7H17NO.C2H6/c1-5-8-7(2,3)6-9-4;1-2/h8H,5-6H2,1-4H3;1-2H3
InChIKeyWRFHUKQHCBVQCF-UHFFFAOYSA-N
MW161.29 g/mol
LogP2.05
Rot. Bonds4

About ethane;N-ethyl-1-methoxy-2-methylpropan-2-amine

ethane;N-ethyl-1-methoxy-2-methylpropan-2-amine (PubChem CID 177317291) has the molecular formula C9H23NO and a molecular weight of 161.29 g/mol. Its IUPAC name is ethane;N-ethyl-1-methoxy-2-methylpropan-2-amine.

Molecular Properties

Compound Nameethane;N-ethyl-1-methoxy-2-methylpropan-2-amine
PubChem CID177317291
Molecular FormulaC9H23NO
Molecular Weight161.29 g/mol
Exact Mass161.18
IUPAC Nameethane;N-ethyl-1-methoxy-2-methylpropan-2-amine
SMILESCC.CCNC(C)(C)COC
InChIInChI=1S/C7H17NO.C2H6/c1-5-8-7(2,3)6-9-4;1-2/h8H,5-6H2,1-4H3;1-2H3
InChIKeyWRFHUKQHCBVQCF-UHFFFAOYSA-N
XLogP2.05
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.29
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze ethane;N-ethyl-1-methoxy-2-methylpropan-2-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

1-methoxy-N-(2-methoxyethyl)-2-methylpropan-2-amine
CID 115609446
N-(1-methoxy-2-methylpropan-2-yl)hexan-1-amine
CID 115644983
N-(2-ethylsulfanylethyl)-1-methoxy-2-methylpropan-2-amine
CID 115648465
N-(1-methoxy-2-methylpropan-2-yl)-2-methylpentan-1-amine
CID 115906085
1-methoxy-2-methyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]propan-2-amine
CID 115609397
4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol
CID 115679518
1-ethyl-3-(1-methoxy-2-methylpropan-2-yl)urea
CID 115690657
N-(1-methoxy-2-methylpropan-2-yl)ethanesulfonamide
CID 115617292
N-ethyl-1,1-dimethoxyethanamine
CID 20509682
3,5-bis(methoxymethyl)-3,5-dimethylheptane
CID 21036025
2-(ethylamino)-2-methylpropan-1-ol
CID 15105174
2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol
CID 115643011

Frequently Asked Questions

What is the IUPAC name of ethane;N-ethyl-1-methoxy-2-methylpropan-2-amine?
The IUPAC name of ethane;N-ethyl-1-methoxy-2-methylpropan-2-amine (CID 177317291) is ethane;N-ethyl-1-methoxy-2-methylpropan-2-amine.
What is the SMILES notation for ethane;N-ethyl-1-methoxy-2-methylpropan-2-amine?
The canonical SMILES for ethane;N-ethyl-1-methoxy-2-methylpropan-2-amine is CC.CCNC(C)(C)COC.
What is the InChIKey of ethane;N-ethyl-1-methoxy-2-methylpropan-2-amine?
The InChIKey is WRFHUKQHCBVQCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO.C2H6/c1-5-8-7(2,3)6-9-4;1-2/h8H,5-6H2,1-4H3;1-2H3.
What are the key properties of ethane;N-ethyl-1-methoxy-2-methylpropan-2-amine?
ethane;N-ethyl-1-methoxy-2-methylpropan-2-amine has a molecular weight of 161.29 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethyl-1-methoxy-2-methylpropan-2-amine is sourced from PubChem (CID 177317291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).