2-(3-propyl-8-tricyclo[5.2.1.02,6]decanyl)ethanamine

C15H27N — CID 134298147

IUPAC2-(3-propyl-8-tricyclo[5.2.1.02,6]decanyl)ethanamine
SMILESCCCC1CCC2C3CC(CC3CCN)C12
InChIInChI=1S/C15H27N/c1-2-3-10-4-5-13-14-9-12(15(10)13)8-11(14)6-7-16/h10-15H,2-9,16H2,1H3
InChIKeyYGHMELVDMRKMSB-UHFFFAOYSA-N
MW221.39 g/mol
LogP3.43
Rot. Bonds4

About 2-(3-propyl-8-tricyclo[5.2.1.02,6]decanyl)ethanamine

2-(3-propyl-8-tricyclo[5.2.1.02,6]decanyl)ethanamine (PubChem CID 134298147) has the molecular formula C15H27N and a molecular weight of 221.39 g/mol. Its IUPAC name is 2-(3-propyl-8-tricyclo[5.2.1.02,6]decanyl)ethanamine.

Molecular Properties

Compound Name2-(3-propyl-8-tricyclo[5.2.1.02,6]decanyl)ethanamine
PubChem CID134298147
Molecular FormulaC15H27N
Molecular Weight221.39 g/mol
Exact Mass221.21
IUPAC Name2-(3-propyl-8-tricyclo[5.2.1.02,6]decanyl)ethanamine
SMILESCCCC1CCC2C3CC(CC3CCN)C12
InChIInChI=1S/C15H27N/c1-2-3-10-4-5-13-14-9-12(15(10)13)8-11(14)6-7-16/h10-15H,2-9,16H2,1H3
InChIKeyYGHMELVDMRKMSB-UHFFFAOYSA-N
XLogP3.43
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.39
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(1-propyl-2,3,4,4a,5,6,7,8,9,10,11,11a-dodecahydro-1H-benzo[9]annulen-4-yl)ethanamine
CID 134174348
2-[7-(2-aminoethyl)-2-bicyclo[2.2.1]heptanyl]ethanamine
CID 139364896
4-methyl-9-propyltetracyclo[6.2.1.13,6.02,7]dodecane
CID 22898213
(1S,2S,3R,5S)-3-propylbicyclo[3.1.0]hexan-2-amine
CID 55284909
2-[5-(2-aminoethyl)-2-bicyclo[2.2.2]octanyl]ethanamine
CID 139034685
N-[2-[8-[2-(prop-2-enoylamino)ethyl]-3-tricyclo[5.2.1.02,6]decanyl]ethyl]prop-2-enamide
CID 135273156
2-methyl-6-propylbicyclo[2.2.0]hexane
CID 123694094
2-(2-cyclopentylcyclopropyl)ethanamine
CID 83826413
1-ethyl-4-propyl-1,2,3,3a,4,5,6,6a-octahydropentalene
CID 167543521
2-[(1R,2S)-2-(1-methylpiperidin-4-yl)cyclopropyl]ethanamine
CID 118406336
(8R)-4-propyl-10,12-dioxapentacyclo[6.5.1.13,6.02,7.09,13]pentadecan-11-one
CID 146261960
(4-methyl-2-propylcyclohexyl)methanamine
CID 81009866

Frequently Asked Questions

What is the IUPAC name of 2-(3-propyl-8-tricyclo[5.2.1.02,6]decanyl)ethanamine?
The IUPAC name of 2-(3-propyl-8-tricyclo[5.2.1.02,6]decanyl)ethanamine (CID 134298147) is 2-(3-propyl-8-tricyclo[5.2.1.02,6]decanyl)ethanamine.
What is the SMILES notation for 2-(3-propyl-8-tricyclo[5.2.1.02,6]decanyl)ethanamine?
The canonical SMILES for 2-(3-propyl-8-tricyclo[5.2.1.02,6]decanyl)ethanamine is CCCC1CCC2C3CC(CC3CCN)C12.
What is the InChIKey of 2-(3-propyl-8-tricyclo[5.2.1.02,6]decanyl)ethanamine?
The InChIKey is YGHMELVDMRKMSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N/c1-2-3-10-4-5-13-14-9-12(15(10)13)8-11(14)6-7-16/h10-15H,2-9,16H2,1H3.
What are the key properties of 2-(3-propyl-8-tricyclo[5.2.1.02,6]decanyl)ethanamine?
2-(3-propyl-8-tricyclo[5.2.1.02,6]decanyl)ethanamine has a molecular weight of 221.39 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-propyl-8-tricyclo[5.2.1.02,6]decanyl)ethanamine is sourced from PubChem (CID 134298147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).