N-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine

C17H28N2 — CID 64776463

IUPACN-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine
SMILESCCNC(c1ncccc1C)C1CCC(CC)CC1
InChIInChI=1S/C17H28N2/c1-4-14-8-10-15(11-9-14)17(18-5-2)16-13(3)7-6-12-19-16/h6-7,12,14-15,17-18H,4-5,8-11H2,1-3H3
InChIKeyBSBIHZXZBRRAPQ-UHFFFAOYSA-N
MW260.42 g/mol
LogP4.26
Rot. Bonds5

About N-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine

N-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine (PubChem CID 64776463) has the molecular formula C17H28N2 and a molecular weight of 260.42 g/mol. Its IUPAC name is N-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine
PubChem CID64776463
Molecular FormulaC17H28N2
Molecular Weight260.42 g/mol
Exact Mass260.23
IUPAC NameN-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine
SMILESCCNC(c1ncccc1C)C1CCC(CC)CC1
InChIInChI=1S/C17H28N2/c1-4-14-8-10-15(11-9-14)17(18-5-2)16-13(3)7-6-12-19-16/h6-7,12,14-15,17-18H,4-5,8-11H2,1-3H3
InChIKeyBSBIHZXZBRRAPQ-UHFFFAOYSA-N
XLogP4.26
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.42
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine
CID 105157241
2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanol
CID 64904867
[(3-bromo-2-pyridinyl)-(4-ethylcyclohexyl)methyl]hydrazine
CID 105268082
N-[(3-methyl-2-pyridinyl)-(2-phenylcyclopropyl)methyl]ethanamine
CID 116517426
[(4-ethylcyclohexyl)-(2-methyl-3-pyridinyl)methyl]hydrazine
CID 105313063
[cyclobutyl-(3-methyl-2-pyridinyl)methyl]hydrazine
CID 105209352
N-[(4-ethylcyclohexyl)-(3-methylphenyl)methyl]ethanamine
CID 64774201
N-[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(4-ethylcyclohexyl)methyl]ethanamine
CID 79740041
(1S)-2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanamine
CID 55293023
[cycloheptyl-(3-methyl-2-pyridinyl)methyl]hydrazine
CID 105209201
N-[cycloheptyl(pyrimidin-2-yl)methyl]ethanamine
CID 82932188
(4-ethylcyclohexyl)-(3-ethyl-2-pyridinyl)methanol
CID 82731157

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine?
The IUPAC name of N-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine (CID 64776463) is N-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine.
What is the SMILES notation for N-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine?
The canonical SMILES for N-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine is CCNC(c1ncccc1C)C1CCC(CC)CC1.
What is the InChIKey of N-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine?
The InChIKey is BSBIHZXZBRRAPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-4-14-8-10-15(11-9-14)17(18-5-2)16-13(3)7-6-12-19-16/h6-7,12,14-15,17-18H,4-5,8-11H2,1-3H3.
What are the key properties of N-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine?
N-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine has a molecular weight of 260.42 g/mol, XLogP of 4.26, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 64776463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).