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

C11H29NO — CID 145315880

IUPACethane;N-ethyl-2-methoxy-N-methylpropan-1-amine
SMILESCC.CC.CCN(C)CC(C)OC
InChIInChI=1S/C7H17NO.2C2H6/c1-5-8(3)6-7(2)9-4;2*1-2/h7H,5-6H2,1-4H3;2*1-2H3
InChIKeyHZHIHDKFDHNYSY-UHFFFAOYSA-N
MW191.36 g/mol
LogP3.03
Rot. Bonds4

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

ethane;N-ethyl-2-methoxy-N-methylpropan-1-amine (PubChem CID 145315880) has the molecular formula C11H29NO and a molecular weight of 191.36 g/mol. Its IUPAC name is ethane;N-ethyl-2-methoxy-N-methylpropan-1-amine.

Molecular Properties

Compound Nameethane;N-ethyl-2-methoxy-N-methylpropan-1-amine
PubChem CID145315880
Molecular FormulaC11H29NO
Molecular Weight191.36 g/mol
Exact Mass191.22
IUPAC Nameethane;N-ethyl-2-methoxy-N-methylpropan-1-amine
SMILESCC.CC.CCN(C)CC(C)OC
InChIInChI=1S/C7H17NO.2C2H6/c1-5-8(3)6-7(2)9-4;2*1-2/h7H,5-6H2,1-4H3;2*1-2H3
InChIKeyHZHIHDKFDHNYSY-UHFFFAOYSA-N
XLogP3.03
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.36
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-methoxy-N,N-bis[(2R)-2-methoxypropyl]propan-1-amine
CID 137384228
ethane;N-ethyl-N,2-dimethylpropan-1-amine
CID 143400672
N'-ethyl-1-methoxy-N,N,N'-trimethylethane-1,2-diamine
CID 178173118
N-(2,2-difluoroethyl)-N-ethyl-2-methoxypropan-1-amine
CID 172573724
(2S)-N-ethyl-N,2-dimethylbutan-1-amine
CID 89086806
(2R)-1-[ethyl(methyl)amino]propane-2-thiol
CID 134269969
1-[ethyl(methyl)amino]-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106991712
N'-ethyl-N',2-dimethylpropane-1,3-diamine
CID 25219171
ethane;N-ethyl-N,3-dimethylbutan-1-amine
CID 143818510
N-ethyl-N-[(2S)-2-methoxypropyl]propanamide
CID 172573690
N-ethyl-N-(2-methoxypropyl)nitramide
CID 141083588
N,N-diethylethanamine;propan-2-ylphosphane
CID 88654253

Frequently Asked Questions

What is the IUPAC name of ethane;N-ethyl-2-methoxy-N-methylpropan-1-amine?
The IUPAC name of ethane;N-ethyl-2-methoxy-N-methylpropan-1-amine (CID 145315880) is ethane;N-ethyl-2-methoxy-N-methylpropan-1-amine.
What is the SMILES notation for ethane;N-ethyl-2-methoxy-N-methylpropan-1-amine?
The canonical SMILES for ethane;N-ethyl-2-methoxy-N-methylpropan-1-amine is CC.CC.CCN(C)CC(C)OC.
What is the InChIKey of ethane;N-ethyl-2-methoxy-N-methylpropan-1-amine?
The InChIKey is HZHIHDKFDHNYSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO.2C2H6/c1-5-8(3)6-7(2)9-4;2*1-2/h7H,5-6H2,1-4H3;2*1-2H3.
What are the key properties of ethane;N-ethyl-2-methoxy-N-methylpropan-1-amine?
ethane;N-ethyl-2-methoxy-N-methylpropan-1-amine has a molecular weight of 191.36 g/mol, XLogP of 3.03, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethyl-2-methoxy-N-methylpropan-1-amine is sourced from PubChem (CID 145315880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).