N'-ethylmethanediamine;methane

C7H26N2 — CID 160877830

IUPACN'-ethylmethanediamine;methane
SMILESC.C.C.C.CCNCN
InChIInChI=1S/C3H10N2.4CH4/c1-2-5-3-4;;;;/h5H,2-4H2,1H3;4*1H4
InChIKeySMQBCARKWBRUCR-UHFFFAOYSA-N
MW138.30 g/mol
LogP2.06
Rot. Bonds2

About N'-ethylmethanediamine;methane

N'-ethylmethanediamine;methane (PubChem CID 160877830) has the molecular formula C7H26N2 and a molecular weight of 138.30 g/mol. Its IUPAC name is N'-ethylmethanediamine;methane.

Molecular Properties

Compound NameN'-ethylmethanediamine;methane
PubChem CID160877830
Molecular FormulaC7H26N2
Molecular Weight138.30 g/mol
Exact Mass138.21
IUPAC NameN'-ethylmethanediamine;methane
SMILESC.C.C.C.CCNCN
InChIInChI=1S/C3H10N2.4CH4/c1-2-5-3-4;;;;/h5H,2-4H2,1H3;4*1H4
InChIKeySMQBCARKWBRUCR-UHFFFAOYSA-N
XLogP2.06
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.30
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

N-ethylethanamine;methane;phosphane
CID 174671169
azane;ethanamine;N-ethylethanamine;propane
CID 160512840
N-(1,2-13C2)ethyl(1,2-13C2)ethanamine
CID 71309791
N-ethylethanamine;yttrium
CID 174702634
N-ethylethanamine;λ2-plumbane
CID 174566138
N-ethylethanamine;platinum
CID 88506582
cerium;N-ethylethanamine
CID 174691303
N-ethylethanamine;titanium(4+)
CID 21151065
N'-ethylethane-1,2-diamine;hydrochloride
CID 19427140
tetrakis(N-ethylethanamine);phosphane;hydrobromide
CID 175008445
N-ethylethanamine;methylphosphane
CID 174625053
N-ethylethanamine;O-ethylhydroxylamine
CID 19097827

Frequently Asked Questions

What is the IUPAC name of N'-ethylmethanediamine;methane?
The IUPAC name of N'-ethylmethanediamine;methane (CID 160877830) is N'-ethylmethanediamine;methane.
What is the SMILES notation for N'-ethylmethanediamine;methane?
The canonical SMILES for N'-ethylmethanediamine;methane is C.C.C.C.CCNCN.
What is the InChIKey of N'-ethylmethanediamine;methane?
The InChIKey is SMQBCARKWBRUCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10N2.4CH4/c1-2-5-3-4;;;;/h5H,2-4H2,1H3;4*1H4.
What are the key properties of N'-ethylmethanediamine;methane?
N'-ethylmethanediamine;methane has a molecular weight of 138.30 g/mol, XLogP of 2.06, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethylmethanediamine;methane is sourced from PubChem (CID 160877830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).