ethane;(1-ethylpyrrolidin-2-yl)methanamine;methane

C10H26N2 — CID 142875932

IUPACethane;(1-ethylpyrrolidin-2-yl)methanamine;methane
SMILESC.CC.CCN1CCCC1CN
InChIInChI=1S/C7H16N2.C2H6.CH4/c1-2-9-5-3-4-7(9)6-8;1-2;/h7H,2-6,8H2,1H3;1-2H3;1H4
InChIKeyJLHLEHQVLBXCFO-UHFFFAOYSA-N
MW174.33 g/mol
LogP2.09
Rot. Bonds2

About ethane;(1-ethylpyrrolidin-2-yl)methanamine;methane

ethane;(1-ethylpyrrolidin-2-yl)methanamine;methane (PubChem CID 142875932) has the molecular formula C10H26N2 and a molecular weight of 174.33 g/mol. Its IUPAC name is ethane;(1-ethylpyrrolidin-2-yl)methanamine;methane.

Molecular Properties

Compound Nameethane;(1-ethylpyrrolidin-2-yl)methanamine;methane
PubChem CID142875932
Molecular FormulaC10H26N2
Molecular Weight174.33 g/mol
Exact Mass174.21
IUPAC Nameethane;(1-ethylpyrrolidin-2-yl)methanamine;methane
SMILESC.CC.CCN1CCCC1CN
InChIInChI=1S/C7H16N2.C2H6.CH4/c1-2-9-5-3-4-7(9)6-8;1-2;/h7H,2-6,8H2,1H3;1-2H3;1H4
InChIKeyJLHLEHQVLBXCFO-UHFFFAOYSA-N
XLogP2.09
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.33
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;(1-ethylpyrrolidin-2-yl)methanamine
CID 142961136
[(2R)-1-ethylpyrrolidin-2-yl]methanamine;hydrochloride
CID 46738121
ethane;1-ethyl-2-propylpyrrolidine
CID 143005022
3-(1-ethylpyrrolidin-2-yl)propan-1-amine
CID 63763897
1,2-diethylpyrrolidine;hydrochloride
CID 175060343
1-ethyl-2-propylpyrrolidine;hydrofluoride
CID 175875195
[1-(1,1,2,2,2-pentadeuterioethyl)pyrrolidin-2-yl]methanamine
CID 59293958
(1-nonylpyrrolidin-2-yl)methanamine
CID 19780174
3-N-[(1-ethylpyrrolidin-2-yl)methyl]-3-N-methylbutane-1,3-diamine
CID 79302990
2-(2-bromopropyl)-1-ethylpyrrolidine
CID 130533962
[(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine
CID 93497649
[1-(2-ethylsulfanylethyl)pyrrolidin-2-yl]methanamine
CID 112702102

Frequently Asked Questions

What is the IUPAC name of ethane;(1-ethylpyrrolidin-2-yl)methanamine;methane?
The IUPAC name of ethane;(1-ethylpyrrolidin-2-yl)methanamine;methane (CID 142875932) is ethane;(1-ethylpyrrolidin-2-yl)methanamine;methane.
What is the SMILES notation for ethane;(1-ethylpyrrolidin-2-yl)methanamine;methane?
The canonical SMILES for ethane;(1-ethylpyrrolidin-2-yl)methanamine;methane is C.CC.CCN1CCCC1CN.
What is the InChIKey of ethane;(1-ethylpyrrolidin-2-yl)methanamine;methane?
The InChIKey is JLHLEHQVLBXCFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2.C2H6.CH4/c1-2-9-5-3-4-7(9)6-8;1-2;/h7H,2-6,8H2,1H3;1-2H3;1H4.
What are the key properties of ethane;(1-ethylpyrrolidin-2-yl)methanamine;methane?
ethane;(1-ethylpyrrolidin-2-yl)methanamine;methane has a molecular weight of 174.33 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(1-ethylpyrrolidin-2-yl)methanamine;methane is sourced from PubChem (CID 142875932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).