ethane;N-ethyl-N-methylethanamine;propane

C10H27N — CID 170620045

IUPACethane;N-ethyl-N-methylethanamine;propane
SMILESCC.CCC.CCN(C)CC
InChIInChI=1S/C5H13N.C3H8.C2H6/c1-4-6(3)5-2;1-3-2;1-2/h4-5H2,1-3H3;3H2,1-2H3;1-2H3
InChIKeyOYEXHQRAEPRBLQ-UHFFFAOYSA-N
MW161.33 g/mol
LogP3.40
Rot. Bonds2

About ethane;N-ethyl-N-methylethanamine;propane

ethane;N-ethyl-N-methylethanamine;propane (PubChem CID 170620045) has the molecular formula C10H27N and a molecular weight of 161.33 g/mol. Its IUPAC name is ethane;N-ethyl-N-methylethanamine;propane.

Molecular Properties

Compound Nameethane;N-ethyl-N-methylethanamine;propane
PubChem CID170620045
Molecular FormulaC10H27N
Molecular Weight161.33 g/mol
Exact Mass161.21
IUPAC Nameethane;N-ethyl-N-methylethanamine;propane
SMILESCC.CCC.CCN(C)CC
InChIInChI=1S/C5H13N.C3H8.C2H6/c1-4-6(3)5-2;1-3-2;1-2/h4-5H2,1-3H3;3H2,1-2H3;1-2H3
InChIKeyOYEXHQRAEPRBLQ-UHFFFAOYSA-N
XLogP3.40
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.33
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine
CID 161494620
ethane;N-ethyl-N-methylethanamine;methanamine;N-methylmethanamine;propane
CID 142350107
N-ethyl-N-methylethanamine;methanamine
CID 145177387
N,N-dimethylpropan-1-amine;N-ethyl-N-methylethanamine
CID 118123590
ethane;N-ethyl-N-methylethanamine;1-methylazepane;1-methylpiperidine
CID 91221856
N,N-dimethylmethanamine;propane
CID 159726621
ethane;N-ethyl-N,2-dimethylpropan-1-amine
CID 143400672
N-ethyl-N-methylethanamine;methanesulfonic acid
CID 121235737
2-chloro-N-ethyl-N-methylethanamine;propane
CID 143204321
N-(iodomethyl)-N-methylethanamine
CID 90317117
N,N-dimethylethanamine;N,N-dimethylmethanamine;ethane
CID 142201174
N'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane
CID 142350934

Frequently Asked Questions

What is the IUPAC name of ethane;N-ethyl-N-methylethanamine;propane?
The IUPAC name of ethane;N-ethyl-N-methylethanamine;propane (CID 170620045) is ethane;N-ethyl-N-methylethanamine;propane.
What is the SMILES notation for ethane;N-ethyl-N-methylethanamine;propane?
The canonical SMILES for ethane;N-ethyl-N-methylethanamine;propane is CC.CCC.CCN(C)CC.
What is the InChIKey of ethane;N-ethyl-N-methylethanamine;propane?
The InChIKey is OYEXHQRAEPRBLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N.C3H8.C2H6/c1-4-6(3)5-2;1-3-2;1-2/h4-5H2,1-3H3;3H2,1-2H3;1-2H3.
What are the key properties of ethane;N-ethyl-N-methylethanamine;propane?
ethane;N-ethyl-N-methylethanamine;propane has a molecular weight of 161.33 g/mol, XLogP of 3.40, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethyl-N-methylethanamine;propane is sourced from PubChem (CID 170620045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).