1-ethylimino-2-methylbutan-2-amine

C7H16N2 — CID 129033469

IUPAC1-ethylimino-2-methylbutan-2-amine
SMILESCC/N=C/C(C)(N)CC
InChIInChI=1S/C7H16N2/c1-4-7(3,8)6-9-5-2/h6H,4-5,8H2,1-3H3/b9-6+
InChIKeyRFHMXCJELDMWBB-RMKNXTFCSA-N
MW128.22 g/mol
LogP1.20
Rot. Bonds3

About 1-ethylimino-2-methylbutan-2-amine

1-ethylimino-2-methylbutan-2-amine (PubChem CID 129033469) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is 1-ethylimino-2-methylbutan-2-amine.

Molecular Properties

Compound Name1-ethylimino-2-methylbutan-2-amine
PubChem CID129033469
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC Name1-ethylimino-2-methylbutan-2-amine
SMILESCC/N=C/C(C)(N)CC
InChIInChI=1S/C7H16N2/c1-4-7(3,8)6-9-5-2/h6H,4-5,8H2,1-3H3/b9-6+
InChIKeyRFHMXCJELDMWBB-RMKNXTFCSA-N
XLogP1.20
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-2,2-dimethylpropan-1-imine;N-ethylethanimine
CID 161369212
N'-ethyl-N-(2-methyl-2-sulfanylpropylidene)methanimidamide
CID 143366592
2-methylbutan-2-amine;propane
CID 91035545
2-methylbutan-2-amine;hydrate
CID 173000674
bis(2-methylpropan-2-amine);propane
CID 160822364
(4Z)-6-ethylimino-2,3-dimethylhexa-1,4-dien-3-amine
CID 163749175
2-methylbutan-2-amine;hydrate;hydrobromide
CID 175153237
2-aminobutan-2-ol;propane
CID 174346487
N-ethylmethanimidoyl fluoride
CID 145275129
tetrakis(3,3-dimethylpentane);methane
CID 159658641
3,3-dimethylpentane;methane
CID 158185076
3,3-dimethylpentane;propane
CID 90942978

Frequently Asked Questions

What is the IUPAC name of 1-ethylimino-2-methylbutan-2-amine?
The IUPAC name of 1-ethylimino-2-methylbutan-2-amine (CID 129033469) is 1-ethylimino-2-methylbutan-2-amine.
What is the SMILES notation for 1-ethylimino-2-methylbutan-2-amine?
The canonical SMILES for 1-ethylimino-2-methylbutan-2-amine is CC/N=C/C(C)(N)CC.
What is the InChIKey of 1-ethylimino-2-methylbutan-2-amine?
The InChIKey is RFHMXCJELDMWBB-RMKNXTFCSA-N. The full InChI is InChI=1S/C7H16N2/c1-4-7(3,8)6-9-5-2/h6H,4-5,8H2,1-3H3/b9-6+.
What are the key properties of 1-ethylimino-2-methylbutan-2-amine?
1-ethylimino-2-methylbutan-2-amine has a molecular weight of 128.22 g/mol, XLogP of 1.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethylimino-2-methylbutan-2-amine is sourced from PubChem (CID 129033469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).