1-(6-cyclohexylcyclohexen-1-yl)pyrrolidine

C16H27N — CID 14892747

IUPAC1-(6-cyclohexylcyclohexen-1-yl)pyrrolidine
SMILESC1=C(N2CCCC2)C(C2CCCCC2)CCC1
InChIInChI=1S/C16H27N/c1-2-8-14(9-3-1)15-10-4-5-11-16(15)17-12-6-7-13-17/h11,14-15H,1-10,12-13H2
InChIKeyDBRDFCXVYHLTTJ-UHFFFAOYSA-N
MW233.40 g/mol
LogP4.35
Rot. Bonds2

About 1-(6-cyclohexylcyclohexen-1-yl)pyrrolidine

1-(6-cyclohexylcyclohexen-1-yl)pyrrolidine (PubChem CID 14892747) has the molecular formula C16H27N and a molecular weight of 233.40 g/mol. Its IUPAC name is 1-(6-cyclohexylcyclohexen-1-yl)pyrrolidine.

Molecular Properties

Compound Name1-(6-cyclohexylcyclohexen-1-yl)pyrrolidine
PubChem CID14892747
Molecular FormulaC16H27N
Molecular Weight233.40 g/mol
Exact Mass233.21
IUPAC Name1-(6-cyclohexylcyclohexen-1-yl)pyrrolidine
SMILESC1=C(N2CCCC2)C(C2CCCCC2)CCC1
InChIInChI=1S/C16H27N/c1-2-8-14(9-3-1)15-10-4-5-11-16(15)17-12-6-7-13-17/h11,14-15H,1-10,12-13H2
InChIKeyDBRDFCXVYHLTTJ-UHFFFAOYSA-N
XLogP4.35
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.40
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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1-(6-Prop-2-enylcyclohexen-1-yl)pyrrolidine
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2-methyl-N-methyldecahydrocyclododeca[b]-pyrrole
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1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine
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1-[6-(1,1,2,2,3,3,4,4,5,5,6,6,6-Tridecafluorohexyl)cyclohexen-1-yl]pyrrolidine
CID 177519031
1-(6-Butylcyclohex-1-en-1-yl)pyrrolidine
CID 53440329
1-(6-Ethylcyclohexen-1-yl)pyrrolidine
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1-(4-Methylcyclohex-1-en-1-yl)pyrrolidine
CID 11171167
1-(5-Methylcyclohexen-1-yl)pyrrolidine
CID 12952197
1-(4-Ethylcyclohexen-1-yl)pyrrolidine
CID 20441911
1-(4-Pentylcyclohexen-1-yl)pyrrolidine
CID 20450679

Frequently Asked Questions

What is the IUPAC name of 1-(6-cyclohexylcyclohexen-1-yl)pyrrolidine?
The IUPAC name of 1-(6-cyclohexylcyclohexen-1-yl)pyrrolidine (CID 14892747) is 1-(6-cyclohexylcyclohexen-1-yl)pyrrolidine.
What is the SMILES notation for 1-(6-cyclohexylcyclohexen-1-yl)pyrrolidine?
The canonical SMILES for 1-(6-cyclohexylcyclohexen-1-yl)pyrrolidine is C1=C(N2CCCC2)C(C2CCCCC2)CCC1.
What is the InChIKey of 1-(6-cyclohexylcyclohexen-1-yl)pyrrolidine?
The InChIKey is DBRDFCXVYHLTTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N/c1-2-8-14(9-3-1)15-10-4-5-11-16(15)17-12-6-7-13-17/h11,14-15H,1-10,12-13H2.
What are the key properties of 1-(6-cyclohexylcyclohexen-1-yl)pyrrolidine?
1-(6-cyclohexylcyclohexen-1-yl)pyrrolidine has a molecular weight of 233.40 g/mol, XLogP of 4.35, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-cyclohexylcyclohexen-1-yl)pyrrolidine is sourced from PubChem (CID 14892747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).