2-(cyclopropylmethyl)bicyclo[3.1.0]hexan-3-imine

C10H15N — CID 163587013

IUPAC2-(cyclopropylmethyl)bicyclo[3.1.0]hexan-3-imine
SMILES[H]/N=C1\CC2CC2C1CC1CC1
InChIInChI=1S/C10H15N/c11-10-5-7-4-8(7)9(10)3-6-1-2-6/h6-9,11H,1-5H2/b11-10+
InChIKeyGMIKSCAYLIZETL-ZHACJKMWSA-N
MW149.24 g/mol
LogP2.46
Rot. Bonds2

About 2-(cyclopropylmethyl)bicyclo[3.1.0]hexan-3-imine

2-(cyclopropylmethyl)bicyclo[3.1.0]hexan-3-imine (PubChem CID 163587013) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is 2-(cyclopropylmethyl)bicyclo[3.1.0]hexan-3-imine.

Molecular Properties

Compound Name2-(cyclopropylmethyl)bicyclo[3.1.0]hexan-3-imine
PubChem CID163587013
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name2-(cyclopropylmethyl)bicyclo[3.1.0]hexan-3-imine
SMILES[H]/N=C1\CC2CC2C1CC1CC1
InChIInChI=1S/C10H15N/c11-10-5-7-4-8(7)9(10)3-6-1-2-6/h6-9,11H,1-5H2/b11-10+
InChIKeyGMIKSCAYLIZETL-ZHACJKMWSA-N
XLogP2.46
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethyl)bicyclo[3.1.0]hexan-3-imine?
The IUPAC name of 2-(cyclopropylmethyl)bicyclo[3.1.0]hexan-3-imine (CID 163587013) is 2-(cyclopropylmethyl)bicyclo[3.1.0]hexan-3-imine.
What is the SMILES notation for 2-(cyclopropylmethyl)bicyclo[3.1.0]hexan-3-imine?
The canonical SMILES for 2-(cyclopropylmethyl)bicyclo[3.1.0]hexan-3-imine is [H]/N=C1\CC2CC2C1CC1CC1.
What is the InChIKey of 2-(cyclopropylmethyl)bicyclo[3.1.0]hexan-3-imine?
The InChIKey is GMIKSCAYLIZETL-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H15N/c11-10-5-7-4-8(7)9(10)3-6-1-2-6/h6-9,11H,1-5H2/b11-10+.
What are the key properties of 2-(cyclopropylmethyl)bicyclo[3.1.0]hexan-3-imine?
2-(cyclopropylmethyl)bicyclo[3.1.0]hexan-3-imine has a molecular weight of 149.24 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethyl)bicyclo[3.1.0]hexan-3-imine is sourced from PubChem (CID 163587013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).