ethane;N-ethyl-N-methylethanamine;methanamine;N-methylmethanamine;propane

C13H39N3 — CID 142350107

IUPACethane;N-ethyl-N-methylethanamine;methanamine;N-methylmethanamine;propane
SMILESCC.CCC.CCN(C)CC.CN.CNC
InChIInChI=1S/C5H13N.C3H8.C2H7N.C2H6.CH5N/c1-4-6(3)5-2;2*1-3-2;2*1-2/h4-5H2,1-3H3;3H2,1-2H3;3H,1-2H3;1-2H3;2H2,1H3
InChIKeyHVPRIWKDJSWXOT-UHFFFAOYSA-N
MW237.48 g/mol
LogP2.81
Rot. Bonds2

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

ethane;N-ethyl-N-methylethanamine;methanamine;N-methylmethanamine;propane (PubChem CID 142350107) has the molecular formula C13H39N3 and a molecular weight of 237.48 g/mol. Its IUPAC name is ethane;N-ethyl-N-methylethanamine;methanamine;N-methylmethanamine;propane.

Molecular Properties

Compound Nameethane;N-ethyl-N-methylethanamine;methanamine;N-methylmethanamine;propane
PubChem CID142350107
Molecular FormulaC13H39N3
Molecular Weight237.48 g/mol
Exact Mass237.31
IUPAC Nameethane;N-ethyl-N-methylethanamine;methanamine;N-methylmethanamine;propane
SMILESCC.CCC.CCN(C)CC.CN.CNC
InChIInChI=1S/C5H13N.C3H8.C2H7N.C2H6.CH5N/c1-4-6(3)5-2;2*1-3-2;2*1-2/h4-5H2,1-3H3;3H2,1-2H3;3H,1-2H3;1-2H3;2H2,1H3
InChIKeyHVPRIWKDJSWXOT-UHFFFAOYSA-N
XLogP2.81
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.48
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;N-ethyl-N-methylethanamine;propane
CID 170620045
N-ethyl-N-methylethanamine;methanamine
CID 145177387
N,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine
CID 161494620
N,N-dimethylethanamine;ethane;methanamine
CID 145153553
CID 161411385
CID 161411385
ethane;methanamine;propane
CID 91195053
N,N-dimethylethanamine;N-methylmethanamine;dihydroiodide
CID 158364938
ethane;N'-ethyl-N,N'-dimethylethane-1,2-diamine
CID 142870975
azane;N,N-dimethylmethanamine;methanamine;N-methylmethanamine
CID 174795186
N-ethyl-N-methylethanamine;methanesulfonic acid
CID 121235737
ethane;methanamine;methane;propane
CID 143798923
ethane;N'-ethyl-N,N'-dimethylethane-1,2-diamine;methanol
CID 144534922

Frequently Asked Questions

What is the IUPAC name of ethane;N-ethyl-N-methylethanamine;methanamine;N-methylmethanamine;propane?
The IUPAC name of ethane;N-ethyl-N-methylethanamine;methanamine;N-methylmethanamine;propane (CID 142350107) is ethane;N-ethyl-N-methylethanamine;methanamine;N-methylmethanamine;propane.
What is the SMILES notation for ethane;N-ethyl-N-methylethanamine;methanamine;N-methylmethanamine;propane?
The canonical SMILES for ethane;N-ethyl-N-methylethanamine;methanamine;N-methylmethanamine;propane is CC.CCC.CCN(C)CC.CN.CNC.
What is the InChIKey of ethane;N-ethyl-N-methylethanamine;methanamine;N-methylmethanamine;propane?
The InChIKey is HVPRIWKDJSWXOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N.C3H8.C2H7N.C2H6.CH5N/c1-4-6(3)5-2;2*1-3-2;2*1-2/h4-5H2,1-3H3;3H2,1-2H3;3H,1-2H3;1-2H3;2H2,1H3.
What are the key properties of ethane;N-ethyl-N-methylethanamine;methanamine;N-methylmethanamine;propane?
ethane;N-ethyl-N-methylethanamine;methanamine;N-methylmethanamine;propane has a molecular weight of 237.48 g/mol, XLogP of 2.81, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethyl-N-methylethanamine;methanamine;N-methylmethanamine;propane is sourced from PubChem (CID 142350107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).