N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine

C17H28N2 — CID 64776867

IUPACN-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine
SMILESCCNC(Cc1cccnc1)C1CCC(CC)CC1
InChIInChI=1S/C17H28N2/c1-3-14-7-9-16(10-8-14)17(19-4-2)12-15-6-5-11-18-13-15/h5-6,11,13-14,16-17,19H,3-4,7-10,12H2,1-2H3
InChIKeyXPHWVEUSDBGKKJ-UHFFFAOYSA-N
MW260.42 g/mol
LogP3.82
Rot. Bonds6

About N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine

N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine (PubChem CID 64776867) has the molecular formula C17H28N2 and a molecular weight of 260.42 g/mol. Its IUPAC name is N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine.

Molecular Properties

Compound NameN-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine
PubChem CID64776867
Molecular FormulaC17H28N2
Molecular Weight260.42 g/mol
Exact Mass260.23
IUPAC NameN-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine
SMILESCCNC(Cc1cccnc1)C1CCC(CC)CC1
InChIInChI=1S/C17H28N2/c1-3-14-7-9-16(10-8-14)17(19-4-2)12-15-6-5-11-18-13-15/h5-6,11,13-14,16-17,19H,3-4,7-10,12H2,1-2H3
InChIKeyXPHWVEUSDBGKKJ-UHFFFAOYSA-N
XLogP3.82
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.42
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-(4-ethylcyclohexyl)-3-pyridin-3-ylpropan-1-amine
CID 105155347
1-(4-tert-butylcyclohexyl)-N-ethyl-2-pyridin-3-ylethanamine
CID 104736394
N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-4-ylethanamine
CID 64774213
N-[1-(4-propylcyclohexyl)-2-pyridin-3-ylethyl]propan-1-amine
CID 104736387
N-ethyl-1-(2-ethylcyclohexyl)-2-pyridin-3-ylethanamine
CID 63861666
N-ethyl-1-(4-ethylcyclohexyl)-2-(3-methylphenyl)ethanamine
CID 64776051
2-(3-chlorophenyl)-N-ethyl-1-(4-ethylcyclohexyl)ethanamine
CID 64776038
1-cyclopropyl-N-ethyl-2-pyridin-4-ylethanamine
CID 63355352
N-ethyl-1-(3-ethylcyclopentyl)-2-phenylethanamine
CID 65412003
N-ethyl-1-(5-methyloxolan-2-yl)-2-pyridin-3-ylethanamine
CID 105034589
N-ethyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)-2-pyridin-3-ylethanamine
CID 113446951
3-[2-(ethylamino)-2-(3-ethylcyclopentyl)ethyl]pyridin-4-amine
CID 65409654

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine?
The IUPAC name of N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine (CID 64776867) is N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine.
What is the SMILES notation for N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine?
The canonical SMILES for N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine is CCNC(Cc1cccnc1)C1CCC(CC)CC1.
What is the InChIKey of N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine?
The InChIKey is XPHWVEUSDBGKKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-3-14-7-9-16(10-8-14)17(19-4-2)12-15-6-5-11-18-13-15/h5-6,11,13-14,16-17,19H,3-4,7-10,12H2,1-2H3.
What are the key properties of N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine?
N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine has a molecular weight of 260.42 g/mol, XLogP of 3.82, 6 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)-2-pyridin-3-ylethanamine is sourced from PubChem (CID 64776867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).