1-[1-(4-ethylcyclohexyl)pyrrolidin-3-yl]ethanamine

C14H28N2 — CID 103975462

IUPAC1-[1-(4-ethylcyclohexyl)pyrrolidin-3-yl]ethanamine
SMILESCCC1CCC(N2CCC(C(C)N)C2)CC1
InChIInChI=1S/C14H28N2/c1-3-12-4-6-14(7-5-12)16-9-8-13(10-16)11(2)15/h11-14H,3-10,15H2,1-2H3
InChIKeyRXDGZUMFPLAPPK-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.62
Rot. Bonds3

About 1-[1-(4-ethylcyclohexyl)pyrrolidin-3-yl]ethanamine

1-[1-(4-ethylcyclohexyl)pyrrolidin-3-yl]ethanamine (PubChem CID 103975462) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 1-[1-(4-ethylcyclohexyl)pyrrolidin-3-yl]ethanamine.

Molecular Properties

Compound Name1-[1-(4-ethylcyclohexyl)pyrrolidin-3-yl]ethanamine
PubChem CID103975462
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name1-[1-(4-ethylcyclohexyl)pyrrolidin-3-yl]ethanamine
SMILESCCC1CCC(N2CCC(C(C)N)C2)CC1
InChIInChI=1S/C14H28N2/c1-3-12-4-6-14(7-5-12)16-9-8-13(10-16)11(2)15/h11-14H,3-10,15H2,1-2H3
InChIKeyRXDGZUMFPLAPPK-UHFFFAOYSA-N
XLogP2.62
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[1-(4-ethylcycloheptyl)piperidin-4-yl]ethanamine
CID 65086223
1-(1-cyclooctylpyrrolidin-3-yl)ethanamine
CID 103975759
1-[4-(4-ethylcyclohexyl)morpholin-2-yl]ethanamine
CID 115314954
1-[1-(4-propylcycloheptyl)piperidin-3-yl]ethanamine
CID 65088932
1-[1-(4-propylcyclohexyl)piperidin-4-yl]ethanamine
CID 63595644
(3R)-1-cyclopropyl-3-propan-2-ylpyrrolidine
CID 176871343
1-cyclopropyl-4-ethylpiperidine;ethane
CID 145311489
1-[1-(3,3-dimethylcyclopentyl)pyrrolidin-3-yl]ethanamine
CID 103975580
1-[1-(3-methylcyclohexyl)pyrrolidin-3-yl]ethanamine
CID 103975545
1-[1-(cyclopropylmethylsulfonyl)pyrrolidin-3-yl]ethanamine
CID 103976089
1-(1-cyclobutylpiperidin-4-yl)ethanamine
CID 63935984
1-(1-cyclohexylpiperidin-4-yl)ethanamine
CID 63594620

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-ethylcyclohexyl)pyrrolidin-3-yl]ethanamine?
The IUPAC name of 1-[1-(4-ethylcyclohexyl)pyrrolidin-3-yl]ethanamine (CID 103975462) is 1-[1-(4-ethylcyclohexyl)pyrrolidin-3-yl]ethanamine.
What is the SMILES notation for 1-[1-(4-ethylcyclohexyl)pyrrolidin-3-yl]ethanamine?
The canonical SMILES for 1-[1-(4-ethylcyclohexyl)pyrrolidin-3-yl]ethanamine is CCC1CCC(N2CCC(C(C)N)C2)CC1.
What is the InChIKey of 1-[1-(4-ethylcyclohexyl)pyrrolidin-3-yl]ethanamine?
The InChIKey is RXDGZUMFPLAPPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-3-12-4-6-14(7-5-12)16-9-8-13(10-16)11(2)15/h11-14H,3-10,15H2,1-2H3.
What are the key properties of 1-[1-(4-ethylcyclohexyl)pyrrolidin-3-yl]ethanamine?
1-[1-(4-ethylcyclohexyl)pyrrolidin-3-yl]ethanamine has a molecular weight of 224.39 g/mol, XLogP of 2.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-ethylcyclohexyl)pyrrolidin-3-yl]ethanamine is sourced from PubChem (CID 103975462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).