1-(1,2-dimethyl-3-propan-2-ylcycloprop-2-en-1-yl)ethanimine

C10H17N — CID 146262602

IUPAC1-(1,2-dimethyl-3-propan-2-ylcycloprop-2-en-1-yl)ethanimine
SMILES[H]/N=C(\C)C1(C)C(C)=C1C(C)C
InChIInChI=1S/C10H17N/c1-6(2)9-7(3)10(9,5)8(4)11/h6,11H,1-5H3/b11-8+
InChIKeyWINNMXZRVCYYHC-DHZHZOJOSA-N
MW151.25 g/mol
LogP3.02
Rot. Bonds2

About 1-(1,2-dimethyl-3-propan-2-ylcycloprop-2-en-1-yl)ethanimine

1-(1,2-dimethyl-3-propan-2-ylcycloprop-2-en-1-yl)ethanimine (PubChem CID 146262602) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 1-(1,2-dimethyl-3-propan-2-ylcycloprop-2-en-1-yl)ethanimine.

Molecular Properties

Compound Name1-(1,2-dimethyl-3-propan-2-ylcycloprop-2-en-1-yl)ethanimine
PubChem CID146262602
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name1-(1,2-dimethyl-3-propan-2-ylcycloprop-2-en-1-yl)ethanimine
SMILES[H]/N=C(\C)C1(C)C(C)=C1C(C)C
InChIInChI=1S/C10H17N/c1-6(2)9-7(3)10(9,5)8(4)11/h6,11H,1-5H3/b11-8+
InChIKeyWINNMXZRVCYYHC-DHZHZOJOSA-N
XLogP3.02
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(1,2-dimethyl-3-propan-2-ylcycloprop-2-en-1-yl)ethanimine?
The IUPAC name of 1-(1,2-dimethyl-3-propan-2-ylcycloprop-2-en-1-yl)ethanimine (CID 146262602) is 1-(1,2-dimethyl-3-propan-2-ylcycloprop-2-en-1-yl)ethanimine.
What is the SMILES notation for 1-(1,2-dimethyl-3-propan-2-ylcycloprop-2-en-1-yl)ethanimine?
The canonical SMILES for 1-(1,2-dimethyl-3-propan-2-ylcycloprop-2-en-1-yl)ethanimine is [H]/N=C(\C)C1(C)C(C)=C1C(C)C.
What is the InChIKey of 1-(1,2-dimethyl-3-propan-2-ylcycloprop-2-en-1-yl)ethanimine?
The InChIKey is WINNMXZRVCYYHC-DHZHZOJOSA-N. The full InChI is InChI=1S/C10H17N/c1-6(2)9-7(3)10(9,5)8(4)11/h6,11H,1-5H3/b11-8+.
What are the key properties of 1-(1,2-dimethyl-3-propan-2-ylcycloprop-2-en-1-yl)ethanimine?
1-(1,2-dimethyl-3-propan-2-ylcycloprop-2-en-1-yl)ethanimine has a molecular weight of 151.25 g/mol, XLogP of 3.02, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2-dimethyl-3-propan-2-ylcycloprop-2-en-1-yl)ethanimine is sourced from PubChem (CID 146262602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).