2-(ethylideneamino)-N,3,4-trimethylcyclobuten-1-amine

C9H16N2 — CID 89263323

IUPAC2-(ethylideneamino)-N,3,4-trimethylcyclobuten-1-amine
SMILESC/C=N/C1=C(NC)C(C)C1C
InChIInChI=1S/C9H16N2/c1-5-11-9-7(3)6(2)8(9)10-4/h5-7,10H,1-4H3/b11-5+
InChIKeyHWAHGAHANMYKOY-VZUCSPMQSA-N
MW152.24 g/mol
LogP1.79
Rot. Bonds2

About 2-(ethylideneamino)-N,3,4-trimethylcyclobuten-1-amine

2-(ethylideneamino)-N,3,4-trimethylcyclobuten-1-amine (PubChem CID 89263323) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 2-(ethylideneamino)-N,3,4-trimethylcyclobuten-1-amine.

Molecular Properties

Compound Name2-(ethylideneamino)-N,3,4-trimethylcyclobuten-1-amine
PubChem CID89263323
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name2-(ethylideneamino)-N,3,4-trimethylcyclobuten-1-amine
SMILESC/C=N/C1=C(NC)C(C)C1C
InChIInChI=1S/C9H16N2/c1-5-11-9-7(3)6(2)8(9)10-4/h5-7,10H,1-4H3/b11-5+
InChIKeyHWAHGAHANMYKOY-VZUCSPMQSA-N
XLogP1.79
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.79
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,3,4-trimethyl-2-(methylideneamino)cyclobuten-1-amine
CID 89263314
(Z)-3-(ethylideneamino)-N,4-dimethylpent-2-en-2-amine
CID 134185811
(Z)-2-(ethylideneamino)-N-methylpent-2-en-3-amine
CID 138643572
ethane;2-(ethylideneamino)-N,3-dimethylcyclohexen-1-amine
CID 143146396
5,6-di(propan-2-yl)-2,7-dihydro-1H-1,4-diazepine
CID 145754098
(Z)-4-(ethylideneamino)-N,2,5-trimethylhex-3-en-3-amine
CID 166678549
N-[(Z)-1-(azetidin-3-yl)pent-2-en-2-yl]propan-1-imine
CID 167486130
N,2,5-trimethyl-1-methyliminohex-2-en-3-amine
CID 173732708
(6R,7S)-2,3,6,7-tetramethyl-2,3,6,7-tetrahydro-1H-pyrrolo[3,2-b]pyridine
CID 142055314
2-(ethylideneamino)-N,3-dimethylcyclohexen-1-amine
CID 143146397

Frequently Asked Questions

What is the IUPAC name of 2-(ethylideneamino)-N,3,4-trimethylcyclobuten-1-amine?
The IUPAC name of 2-(ethylideneamino)-N,3,4-trimethylcyclobuten-1-amine (CID 89263323) is 2-(ethylideneamino)-N,3,4-trimethylcyclobuten-1-amine.
What is the SMILES notation for 2-(ethylideneamino)-N,3,4-trimethylcyclobuten-1-amine?
The canonical SMILES for 2-(ethylideneamino)-N,3,4-trimethylcyclobuten-1-amine is C/C=N/C1=C(NC)C(C)C1C.
What is the InChIKey of 2-(ethylideneamino)-N,3,4-trimethylcyclobuten-1-amine?
The InChIKey is HWAHGAHANMYKOY-VZUCSPMQSA-N. The full InChI is InChI=1S/C9H16N2/c1-5-11-9-7(3)6(2)8(9)10-4/h5-7,10H,1-4H3/b11-5+.
What are the key properties of 2-(ethylideneamino)-N,3,4-trimethylcyclobuten-1-amine?
2-(ethylideneamino)-N,3,4-trimethylcyclobuten-1-amine has a molecular weight of 152.24 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylideneamino)-N,3,4-trimethylcyclobuten-1-amine is sourced from PubChem (CID 89263323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).