N-ethyl-1-(4-ethylcyclohexyl)-3-pyridin-3-ylpropan-1-amine

C18H30N2 — CID 105155347

IUPACN-ethyl-1-(4-ethylcyclohexyl)-3-pyridin-3-ylpropan-1-amine
SMILESCCNC(CCc1cccnc1)C1CCC(CC)CC1
InChIInChI=1S/C18H30N2/c1-3-15-7-10-17(11-8-15)18(20-4-2)12-9-16-6-5-13-19-14-16/h5-6,13-15,17-18,20H,3-4,7-12H2,1-2H3
InChIKeyVKPHXSRJZVYAMA-UHFFFAOYSA-N
MW274.45 g/mol
LogP4.21
Rot. Bonds7

About N-ethyl-1-(4-ethylcyclohexyl)-3-pyridin-3-ylpropan-1-amine

N-ethyl-1-(4-ethylcyclohexyl)-3-pyridin-3-ylpropan-1-amine (PubChem CID 105155347) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is N-ethyl-1-(4-ethylcyclohexyl)-3-pyridin-3-ylpropan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(4-ethylcyclohexyl)-3-pyridin-3-ylpropan-1-amine
PubChem CID105155347
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC NameN-ethyl-1-(4-ethylcyclohexyl)-3-pyridin-3-ylpropan-1-amine
SMILESCCNC(CCc1cccnc1)C1CCC(CC)CC1
InChIInChI=1S/C18H30N2/c1-3-15-7-10-17(11-8-15)18(20-4-2)12-9-16-6-5-13-19-14-16/h5-6,13-15,17-18,20H,3-4,7-12H2,1-2H3
InChIKeyVKPHXSRJZVYAMA-UHFFFAOYSA-N
XLogP4.21
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.45
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine
CID 64776867
N-ethyl-1-(4-ethylcyclohexyl)-4-phenylbutan-1-amine
CID 65394984
1-cycloheptyl-N-methyl-3-pyridin-3-ylpropan-1-amine
CID 105176320
N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-4-ylethanamine
CID 64774213
N-ethyl-1-(2-phenylcyclopropyl)-3-pyridin-3-ylpropan-1-amine
CID 105189087
1-(4-tert-butylcyclohexyl)-N-ethyl-2-pyridin-3-ylethanamine
CID 104736394
1-cyclopropyl-N-ethyl-3-(4-methyl-3-pyridinyl)propan-1-amine
CID 66272541
[1-(4-ethylcyclohexyl)-3-phenylpropyl]hydrazine
CID 105205691
N-ethyl-1-phenyl-5-pyridin-3-ylpentan-3-amine
CID 105094322
N-ethyl-1-(4-methyl-3-pyridinyl)-3-pyridin-3-ylpropan-1-amine
CID 105164345
N-[1-(4-propylcyclohexyl)-2-pyridin-3-ylethyl]propan-1-amine
CID 104736387
N-ethyl-1-(2-ethylcyclohexyl)-2-pyridin-3-ylethanamine
CID 63861666

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-ethylcyclohexyl)-3-pyridin-3-ylpropan-1-amine?
The IUPAC name of N-ethyl-1-(4-ethylcyclohexyl)-3-pyridin-3-ylpropan-1-amine (CID 105155347) is N-ethyl-1-(4-ethylcyclohexyl)-3-pyridin-3-ylpropan-1-amine.
What is the SMILES notation for N-ethyl-1-(4-ethylcyclohexyl)-3-pyridin-3-ylpropan-1-amine?
The canonical SMILES for N-ethyl-1-(4-ethylcyclohexyl)-3-pyridin-3-ylpropan-1-amine is CCNC(CCc1cccnc1)C1CCC(CC)CC1.
What is the InChIKey of N-ethyl-1-(4-ethylcyclohexyl)-3-pyridin-3-ylpropan-1-amine?
The InChIKey is VKPHXSRJZVYAMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2/c1-3-15-7-10-17(11-8-15)18(20-4-2)12-9-16-6-5-13-19-14-16/h5-6,13-15,17-18,20H,3-4,7-12H2,1-2H3.
What are the key properties of N-ethyl-1-(4-ethylcyclohexyl)-3-pyridin-3-ylpropan-1-amine?
N-ethyl-1-(4-ethylcyclohexyl)-3-pyridin-3-ylpropan-1-amine has a molecular weight of 274.45 g/mol, XLogP of 4.21, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(4-ethylcyclohexyl)-3-pyridin-3-ylpropan-1-amine is sourced from PubChem (CID 105155347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).