1-(5-methyl-2-propan-2-ylcyclohexen-1-yl)pyrrolidine

C14H25N — CID 606013

IUPAC1-(5-methyl-2-propan-2-ylcyclohexen-1-yl)pyrrolidine
SMILESCC1CCC(C(C)C)=C(N2CCCC2)C1
InChIInChI=1S/C14H25N/c1-11(2)13-7-6-12(3)10-14(13)15-8-4-5-9-15/h11-12H,4-10H2,1-3H3
InChIKeyXFHNWIDLFQXTOG-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.81
Rot. Bonds2

About 1-(5-methyl-2-propan-2-ylcyclohexen-1-yl)pyrrolidine

1-(5-methyl-2-propan-2-ylcyclohexen-1-yl)pyrrolidine (PubChem CID 606013) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is 1-(5-methyl-2-propan-2-ylcyclohexen-1-yl)pyrrolidine.

Molecular Properties

Compound Name1-(5-methyl-2-propan-2-ylcyclohexen-1-yl)pyrrolidine
PubChem CID606013
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name1-(5-methyl-2-propan-2-ylcyclohexen-1-yl)pyrrolidine
SMILESCC1CCC(C(C)C)=C(N2CCCC2)C1
InChIInChI=1S/C14H25N/c1-11(2)13-7-6-12(3)10-14(13)15-8-4-5-9-15/h11-12H,4-10H2,1-3H3
InChIKeyXFHNWIDLFQXTOG-UHFFFAOYSA-N
XLogP3.81
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1H-3a-Aza-as-indacene, 8b-methyl-2-propyl-2,3,4,5,6,7,8,8b-octahydro-
CID 3112660
Pyrrolidine, 1-(2-methyl-1-cyclohexen-1-yl)-
CID 12218076
2-Ethyl-4,9b-dimethyl-1,2,3,5,6,7,8,9-octahydrocyclopenta[g]indolizin-4-ium
CID 3098406
5-Fluoro-1,4-dimethyl-2,3,4,5,6,7-hexahydroindole
CID 68362918
(1R,5S)-2-fluoro-8-methyl-3-propan-2-yl-8-azabicyclo[3.2.1]oct-2-ene
CID 176585487
(1S,5R)-2-fluoro-8-methyl-3-propan-2-yl-8-azabicyclo[3.2.1]oct-2-ene
CID 176585491
1-(2,6-Dimethylcyclohexen-1-yl)pyrrolidine
CID 100947708
1-[(6R)-6-propan-2-ylcyclohexen-1-yl]pyrrolidine
CID 134863432
1-(2,6,6-Trimethylcyclohexen-1-yl)pyrrolidine
CID 134863459
2,5-Dimethyl-1-(2-methylcyclohexen-1-yl)pyrrolidine
CID 134992735
(2R,5R)-2,5-dimethyl-1-(2-methylcyclohexen-1-yl)pyrrolidine
CID 134996456
2,9b-dimethyl-2,3,5,6,7,8,9,9b-octahydro-1H-cyclopenta[g]indolizine
CID 145919101

Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-2-propan-2-ylcyclohexen-1-yl)pyrrolidine?
The IUPAC name of 1-(5-methyl-2-propan-2-ylcyclohexen-1-yl)pyrrolidine (CID 606013) is 1-(5-methyl-2-propan-2-ylcyclohexen-1-yl)pyrrolidine.
What is the SMILES notation for 1-(5-methyl-2-propan-2-ylcyclohexen-1-yl)pyrrolidine?
The canonical SMILES for 1-(5-methyl-2-propan-2-ylcyclohexen-1-yl)pyrrolidine is CC1CCC(C(C)C)=C(N2CCCC2)C1.
What is the InChIKey of 1-(5-methyl-2-propan-2-ylcyclohexen-1-yl)pyrrolidine?
The InChIKey is XFHNWIDLFQXTOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-11(2)13-7-6-12(3)10-14(13)15-8-4-5-9-15/h11-12H,4-10H2,1-3H3.
What are the key properties of 1-(5-methyl-2-propan-2-ylcyclohexen-1-yl)pyrrolidine?
1-(5-methyl-2-propan-2-ylcyclohexen-1-yl)pyrrolidine has a molecular weight of 207.36 g/mol, XLogP of 3.81, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-2-propan-2-ylcyclohexen-1-yl)pyrrolidine is sourced from PubChem (CID 606013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).