ethane;5-methoxy-N,N,2,3-tetramethylpentan-1-amine

C12H29NO — CID 144662875

IUPACethane;5-methoxy-N,N,2,3-tetramethylpentan-1-amine
SMILESCC.COCCC(C)C(C)CN(C)C
InChIInChI=1S/C10H23NO.C2H6/c1-9(6-7-12-5)10(2)8-11(3)4;1-2/h9-10H,6-8H2,1-5H3;1-2H3
InChIKeyLHCZHEIRGGGMOR-UHFFFAOYSA-N
MW203.37 g/mol
LogP2.88
Rot. Bonds6

About ethane;5-methoxy-N,N,2,3-tetramethylpentan-1-amine

ethane;5-methoxy-N,N,2,3-tetramethylpentan-1-amine (PubChem CID 144662875) has the molecular formula C12H29NO and a molecular weight of 203.37 g/mol. Its IUPAC name is ethane;5-methoxy-N,N,2,3-tetramethylpentan-1-amine.

Molecular Properties

Compound Nameethane;5-methoxy-N,N,2,3-tetramethylpentan-1-amine
PubChem CID144662875
Molecular FormulaC12H29NO
Molecular Weight203.37 g/mol
Exact Mass203.22
IUPAC Nameethane;5-methoxy-N,N,2,3-tetramethylpentan-1-amine
SMILESCC.COCCC(C)C(C)CN(C)C
InChIInChI=1S/C10H23NO.C2H6/c1-9(6-7-12-5)10(2)8-11(3)4;1-2/h9-10H,6-8H2,1-5H3;1-2H3
InChIKeyLHCZHEIRGGGMOR-UHFFFAOYSA-N
XLogP2.88
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.37
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-methoxy-N,N,2,3-tetramethylpentan-1-amine
CID 144662876
(2R,3R)-4-methoxy-N,N,2,3-tetramethylbutan-1-amine
CID 163903931
ethane;1-methoxy-3-methylbutane
CID 144580604
(2R)-N,N,2,3-tetramethylpentan-1-amine
CID 130182039
6-methoxy-3,4-dimethylhexanoic acid
CID 116500421
ethane;4-methoxy-N-methyl-N-propylbutan-2-amine
CID 153329732
5-[3-amino-5-(dimethylamino)-4-methylpentoxy]-1-N,1-N,2-trimethylpentane-1,3-diamine
CID 88716268
5-methoxy-1-N,1-N-dimethylpentane-1,2-diamine
CID 81101856
1-(dimethylamino)-3-[(1-methoxy-4-methylpentan-3-yl)amino]propan-2-ol
CID 115718065
4-methoxy-1-N,1-N-bis(2-methylpropyl)butane-1,2-diamine
CID 62475448
(2S)-N,N,N',2,3-pentamethyl-N'-[(2R)-2-methylbutyl]pentane-1,5-diamine
CID 170265960
1-[bis(2-methoxyethyl)amino]propan-2-ol
CID 59693413

Frequently Asked Questions

What is the IUPAC name of ethane;5-methoxy-N,N,2,3-tetramethylpentan-1-amine?
The IUPAC name of ethane;5-methoxy-N,N,2,3-tetramethylpentan-1-amine (CID 144662875) is ethane;5-methoxy-N,N,2,3-tetramethylpentan-1-amine.
What is the SMILES notation for ethane;5-methoxy-N,N,2,3-tetramethylpentan-1-amine?
The canonical SMILES for ethane;5-methoxy-N,N,2,3-tetramethylpentan-1-amine is CC.COCCC(C)C(C)CN(C)C.
What is the InChIKey of ethane;5-methoxy-N,N,2,3-tetramethylpentan-1-amine?
The InChIKey is LHCZHEIRGGGMOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO.C2H6/c1-9(6-7-12-5)10(2)8-11(3)4;1-2/h9-10H,6-8H2,1-5H3;1-2H3.
What are the key properties of ethane;5-methoxy-N,N,2,3-tetramethylpentan-1-amine?
ethane;5-methoxy-N,N,2,3-tetramethylpentan-1-amine has a molecular weight of 203.37 g/mol, XLogP of 2.88, 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,2,3-tetramethylpentan-1-amine is sourced from PubChem (CID 144662875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).