5-cyclohexyl-N-(2-cyclohexylethyl)-2-methylidene-1-propylpyridin-3-amine

C23H38N2 — CID 139313527

IUPAC5-cyclohexyl-N-(2-cyclohexylethyl)-2-methylidene-1-propylpyridin-3-amine
SMILESC=C1C(NCCC2CCCCC2)=CC(C2CCCCC2)=CN1CCC
InChIInChI=1S/C23H38N2/c1-3-16-25-18-22(21-12-8-5-9-13-21)17-23(19(25)2)24-15-14-20-10-6-4-7-11-20/h17-18,20-21,24H,2-16H2,1H3
InChIKeyNPKCRZVXLPZICN-UHFFFAOYSA-N
MW342.57 g/mol
LogP6.13
Rot. Bonds7

About 5-cyclohexyl-N-(2-cyclohexylethyl)-2-methylidene-1-propylpyridin-3-amine

5-cyclohexyl-N-(2-cyclohexylethyl)-2-methylidene-1-propylpyridin-3-amine (PubChem CID 139313527) has the molecular formula C23H38N2 and a molecular weight of 342.57 g/mol. Its IUPAC name is 5-cyclohexyl-N-(2-cyclohexylethyl)-2-methylidene-1-propylpyridin-3-amine.

Molecular Properties

Compound Name5-cyclohexyl-N-(2-cyclohexylethyl)-2-methylidene-1-propylpyridin-3-amine
PubChem CID139313527
Molecular FormulaC23H38N2
Molecular Weight342.57 g/mol
Exact Mass342.30
IUPAC Name5-cyclohexyl-N-(2-cyclohexylethyl)-2-methylidene-1-propylpyridin-3-amine
SMILESC=C1C(NCCC2CCCCC2)=CC(C2CCCCC2)=CN1CCC
InChIInChI=1S/C23H38N2/c1-3-16-25-18-22(21-12-8-5-9-13-21)17-23(19(25)2)24-15-14-20-10-6-4-7-11-20/h17-18,20-21,24H,2-16H2,1H3
InChIKeyNPKCRZVXLPZICN-UHFFFAOYSA-N
XLogP6.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.57
LogP ≤ 56.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(E)-1-[3-(2-cyclohexylethylamino)-5-cyclopentyl-2-methylidene-1-pyridinyl]prop-1-ene-1-thiol
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propylcyclotetradecane
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N-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine
CID 106563379
2-cyclohexyl-4-methyl-6-methylidene-1-propylpyridine
CID 155198744
N-(2-cyclohexylethyl)-5-methyl-2-propoxyaniline
CID 83961757
formaldehyde;propylcyclohexane
CID 174845889
N-(2-cyclohexylethyl)-4-ethoxypyrimidin-2-amine
CID 112636877

Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-N-(2-cyclohexylethyl)-2-methylidene-1-propylpyridin-3-amine?
The IUPAC name of 5-cyclohexyl-N-(2-cyclohexylethyl)-2-methylidene-1-propylpyridin-3-amine (CID 139313527) is 5-cyclohexyl-N-(2-cyclohexylethyl)-2-methylidene-1-propylpyridin-3-amine.
What is the SMILES notation for 5-cyclohexyl-N-(2-cyclohexylethyl)-2-methylidene-1-propylpyridin-3-amine?
The canonical SMILES for 5-cyclohexyl-N-(2-cyclohexylethyl)-2-methylidene-1-propylpyridin-3-amine is C=C1C(NCCC2CCCCC2)=CC(C2CCCCC2)=CN1CCC.
What is the InChIKey of 5-cyclohexyl-N-(2-cyclohexylethyl)-2-methylidene-1-propylpyridin-3-amine?
The InChIKey is NPKCRZVXLPZICN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H38N2/c1-3-16-25-18-22(21-12-8-5-9-13-21)17-23(19(25)2)24-15-14-20-10-6-4-7-11-20/h17-18,20-21,24H,2-16H2,1H3.
What are the key properties of 5-cyclohexyl-N-(2-cyclohexylethyl)-2-methylidene-1-propylpyridin-3-amine?
5-cyclohexyl-N-(2-cyclohexylethyl)-2-methylidene-1-propylpyridin-3-amine has a molecular weight of 342.57 g/mol, XLogP of 6.13, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-N-(2-cyclohexylethyl)-2-methylidene-1-propylpyridin-3-amine is sourced from PubChem (CID 139313527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).