N-(cyclohepten-1-yl)cycloheptanimine

C14H23N — CID 57107350

IUPACN-(cyclohepten-1-yl)cycloheptanimine
SMILESC1=C(N=C2CCCCCC2)CCCCC1
InChIInChI=1S/C14H23N/c1-2-6-10-13(9-5-1)15-14-11-7-3-4-8-12-14/h9H,1-8,10-12H2
InChIKeyWEUIWSXDDVQRGQ-UHFFFAOYSA-N
MW205.34 g/mol
LogP4.63
Rot. Bonds1

About N-(cyclohepten-1-yl)cycloheptanimine

N-(cyclohepten-1-yl)cycloheptanimine (PubChem CID 57107350) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is N-(cyclohepten-1-yl)cycloheptanimine.

Molecular Properties

Compound NameN-(cyclohepten-1-yl)cycloheptanimine
PubChem CID57107350
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC NameN-(cyclohepten-1-yl)cycloheptanimine
SMILESC1=C(N=C2CCCCCC2)CCCCC1
InChIInChI=1S/C14H23N/c1-2-6-10-13(9-5-1)15-14-11-7-3-4-8-12-14/h9H,1-8,10-12H2
InChIKeyWEUIWSXDDVQRGQ-UHFFFAOYSA-N
XLogP4.63
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 54.63
H-Bond Donors ≤ 50
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 N-(cyclohepten-1-yl)cycloheptanimine?
The IUPAC name of N-(cyclohepten-1-yl)cycloheptanimine (CID 57107350) is N-(cyclohepten-1-yl)cycloheptanimine.
What is the SMILES notation for N-(cyclohepten-1-yl)cycloheptanimine?
The canonical SMILES for N-(cyclohepten-1-yl)cycloheptanimine is C1=C(N=C2CCCCCC2)CCCCC1.
What is the InChIKey of N-(cyclohepten-1-yl)cycloheptanimine?
The InChIKey is WEUIWSXDDVQRGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-2-6-10-13(9-5-1)15-14-11-7-3-4-8-12-14/h9H,1-8,10-12H2.
What are the key properties of N-(cyclohepten-1-yl)cycloheptanimine?
N-(cyclohepten-1-yl)cycloheptanimine has a molecular weight of 205.34 g/mol, XLogP of 4.63, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohepten-1-yl)cycloheptanimine is sourced from PubChem (CID 57107350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).