3-[(4-ethylcyclohexyl)methyl]pyridin-4-amine

C14H22N2 — CID 64776930

IUPAC3-[(4-ethylcyclohexyl)methyl]pyridin-4-amine
SMILESCCC1CCC(Cc2cnccc2N)CC1
InChIInChI=1S/C14H22N2/c1-2-11-3-5-12(6-4-11)9-13-10-16-8-7-14(13)15/h7-8,10-12H,2-6,9H2,1H3,(H2,15,16)
InChIKeyAPZXWUCVTFVJHR-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.42
Rot. Bonds3

About 3-[(4-ethylcyclohexyl)methyl]pyridin-4-amine

3-[(4-ethylcyclohexyl)methyl]pyridin-4-amine (PubChem CID 64776930) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 3-[(4-ethylcyclohexyl)methyl]pyridin-4-amine.

Molecular Properties

Compound Name3-[(4-ethylcyclohexyl)methyl]pyridin-4-amine
PubChem CID64776930
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name3-[(4-ethylcyclohexyl)methyl]pyridin-4-amine
SMILESCCC1CCC(Cc2cnccc2N)CC1
InChIInChI=1S/C14H22N2/c1-2-11-3-5-12(6-4-11)9-13-10-16-8-7-14(13)15/h7-8,10-12H,2-6,9H2,1H3,(H2,15,16)
InChIKeyAPZXWUCVTFVJHR-UHFFFAOYSA-N
XLogP3.42
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[(4-ethylcyclohexyl)methyl]pyridin-4-amine?
The IUPAC name of 3-[(4-ethylcyclohexyl)methyl]pyridin-4-amine (CID 64776930) is 3-[(4-ethylcyclohexyl)methyl]pyridin-4-amine.
What is the SMILES notation for 3-[(4-ethylcyclohexyl)methyl]pyridin-4-amine?
The canonical SMILES for 3-[(4-ethylcyclohexyl)methyl]pyridin-4-amine is CCC1CCC(Cc2cnccc2N)CC1.
What is the InChIKey of 3-[(4-ethylcyclohexyl)methyl]pyridin-4-amine?
The InChIKey is APZXWUCVTFVJHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-2-11-3-5-12(6-4-11)9-13-10-16-8-7-14(13)15/h7-8,10-12H,2-6,9H2,1H3,(H2,15,16).
What are the key properties of 3-[(4-ethylcyclohexyl)methyl]pyridin-4-amine?
3-[(4-ethylcyclohexyl)methyl]pyridin-4-amine has a molecular weight of 218.34 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-ethylcyclohexyl)methyl]pyridin-4-amine is sourced from PubChem (CID 64776930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).