1-(1,3-diethyl-3-methylcyclohexyl)pyrrolidine

C15H29N — CID 129273725

IUPAC1-(1,3-diethyl-3-methylcyclohexyl)pyrrolidine
SMILESCCC1(C)CCCC(CC)(N2CCCC2)C1
InChIInChI=1S/C15H29N/c1-4-14(3)9-8-10-15(5-2,13-14)16-11-6-7-12-16/h4-13H2,1-3H3
InChIKeyAVOGLTCZTLCXSC-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.22
Rot. Bonds3

About 1-(1,3-diethyl-3-methylcyclohexyl)pyrrolidine

1-(1,3-diethyl-3-methylcyclohexyl)pyrrolidine (PubChem CID 129273725) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 1-(1,3-diethyl-3-methylcyclohexyl)pyrrolidine.

Molecular Properties

Compound Name1-(1,3-diethyl-3-methylcyclohexyl)pyrrolidine
PubChem CID129273725
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name1-(1,3-diethyl-3-methylcyclohexyl)pyrrolidine
SMILESCCC1(C)CCCC(CC)(N2CCCC2)C1
InChIInChI=1S/C15H29N/c1-4-14(3)9-8-10-15(5-2,13-14)16-11-6-7-12-16/h4-13H2,1-3H3
InChIKeyAVOGLTCZTLCXSC-UHFFFAOYSA-N
XLogP4.22
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

8-ethyl-1,2,3,5,6,7-hexahydropyrrolizine;hydrofluoride
CID 168881533
ethane;(8S)-8-ethyl-6,6-difluoro-2,3,5,7-tetrahydro-1H-pyrrolizine
CID 176919647
1-(3-ethyl-1,3,5,5-tetramethylcyclohexyl)pyrrolidine
CID 10331738
8a-ethyl-1,3,5,6,7,8-hexahydro-[1,3]oxazolo[3,4-a]pyridine
CID 122662743
N-[(1-piperidin-1-ylcyclohexyl)methyl]ethanamine;dihydrochloride
CID 21409916
1-(1-ethylcyclopropyl)piperazine
CID 83694598
[1-(azepan-1-yl)cyclopentyl]methanol
CID 104549393
(1-pyrrolidin-1-ylcyclopropyl)methanamine
CID 106660987
8a-(methoxymethyl)-2,3,5,6,7,8-hexahydro-1H-indolizine;ethane
CID 164878560
1-ethyl-4,7-dimethyl-11-azatricyclo[5.3.1.04,11]undecane
CID 134550923
1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine
CID 155794244
N-[(1-piperidin-1-ylcyclohexyl)methyl]thiohydroxylamine
CID 163582901

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-diethyl-3-methylcyclohexyl)pyrrolidine?
The IUPAC name of 1-(1,3-diethyl-3-methylcyclohexyl)pyrrolidine (CID 129273725) is 1-(1,3-diethyl-3-methylcyclohexyl)pyrrolidine.
What is the SMILES notation for 1-(1,3-diethyl-3-methylcyclohexyl)pyrrolidine?
The canonical SMILES for 1-(1,3-diethyl-3-methylcyclohexyl)pyrrolidine is CCC1(C)CCCC(CC)(N2CCCC2)C1.
What is the InChIKey of 1-(1,3-diethyl-3-methylcyclohexyl)pyrrolidine?
The InChIKey is AVOGLTCZTLCXSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-4-14(3)9-8-10-15(5-2,13-14)16-11-6-7-12-16/h4-13H2,1-3H3.
What are the key properties of 1-(1,3-diethyl-3-methylcyclohexyl)pyrrolidine?
1-(1,3-diethyl-3-methylcyclohexyl)pyrrolidine has a molecular weight of 223.40 g/mol, XLogP of 4.22, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-diethyl-3-methylcyclohexyl)pyrrolidine is sourced from PubChem (CID 129273725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).