1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine

C13H23N — CID 134863432

IUPAC1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine
SMILESCC(C)[C@H]1CCCC=C1N1CCCC1
InChIInChI=1S/C13H23N/c1-11(2)12-7-3-4-8-13(12)14-9-5-6-10-14/h8,11-12H,3-7,9-10H2,1-2H3/t12-/m1/s1
InChIKeyZIVKAYGKHZGFQV-GFCCVEGCSA-N
MW193.33 g/mol
LogP3.42
Rot. Bonds2

About 1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine

1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine (PubChem CID 134863432) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is 1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine.

Molecular Properties

Compound Name1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine
PubChem CID134863432
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC Name1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine
SMILESCC(C)[C@H]1CCCC=C1N1CCCC1
InChIInChI=1S/C13H23N/c1-11(2)12-7-3-4-8-13(12)14-9-5-6-10-14/h8,11-12H,3-7,9-10H2,1-2H3/t12-/m1/s1
InChIKeyZIVKAYGKHZGFQV-GFCCVEGCSA-N
XLogP3.42
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-[4-(Tert-butyl)-1-cyclohexen-1-YL]pyrrolidine
CID 107232
Pyrrolidine, 1-(6-methyl-1-cyclohexen-1-yl)-
CID 11030177
1-(4,4-Dimethyl-cyclohex-1-enyl)-pyrrolidine
CID 13494917
1-(Bicyclo[2.2.1]hept-2-en-2-yl)pyrrolidine
CID 14297057
5-Methyl-1-pyrrolidino-1-cyclopentene
CID 15662771
Octahydro-n-ethylcarbazole
CID 69282469
hexahydro-N-methylindole
CID 129642426
5-Cyclohexa-2,4-dien-1-yl-3-fluoro-1-methyl-2-methylidenepyrrolidine
CID 175611923
1-(3-Bicyclo[3.2.1]oct-3-enyl)pyrrolidine
CID 590630
1-[(1R,4S)-2-bicyclo[2.2.1]hept-2-enyl]pyrrolidine
CID 11457867
1-(6-Prop-2-enylcyclohexen-1-yl)pyrrolidine
CID 11600830
1-(6,6-Dimethylcyclohexen-1-yl)pyrrolidine
CID 12475890

Frequently Asked Questions

What is the IUPAC name of 1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine?
The IUPAC name of 1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine (CID 134863432) is 1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine.
What is the SMILES notation for 1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine?
The canonical SMILES for 1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine is CC(C)[C@H]1CCCC=C1N1CCCC1.
What is the InChIKey of 1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine?
The InChIKey is ZIVKAYGKHZGFQV-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H23N/c1-11(2)12-7-3-4-8-13(12)14-9-5-6-10-14/h8,11-12H,3-7,9-10H2,1-2H3/t12-/m1/s1.
What are the key properties of 1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine?
1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine has a molecular weight of 193.33 g/mol, XLogP of 3.42, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine is sourced from PubChem (CID 134863432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).