2-cyclohexyl-4-(5-methylpyrazolidin-1-yl)-1,2,3,6-tetrahydropyridin-3-amine

C15H28N4 — CID 138645340

IUPAC2-cyclohexyl-4-(5-methylpyrazolidin-1-yl)-1,2,3,6-tetrahydropyridin-3-amine
SMILESCC1CCNN1C1=CCNC(C2CCCCC2)C1N
InChIInChI=1S/C15H28N4/c1-11-7-10-18-19(11)13-8-9-17-15(14(13)16)12-5-3-2-4-6-12/h8,11-12,14-15,17-18H,2-7,9-10,16H2,1H3
InChIKeyJOEUKIPGDDVSHU-UHFFFAOYSA-N
MW264.42 g/mol
LogP1.35
Rot. Bonds2

About 2-cyclohexyl-4-(5-methylpyrazolidin-1-yl)-1,2,3,6-tetrahydropyridin-3-amine

2-cyclohexyl-4-(5-methylpyrazolidin-1-yl)-1,2,3,6-tetrahydropyridin-3-amine (PubChem CID 138645340) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 2-cyclohexyl-4-(5-methylpyrazolidin-1-yl)-1,2,3,6-tetrahydropyridin-3-amine.

Molecular Properties

Compound Name2-cyclohexyl-4-(5-methylpyrazolidin-1-yl)-1,2,3,6-tetrahydropyridin-3-amine
PubChem CID138645340
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name2-cyclohexyl-4-(5-methylpyrazolidin-1-yl)-1,2,3,6-tetrahydropyridin-3-amine
SMILESCC1CCNN1C1=CCNC(C2CCCCC2)C1N
InChIInChI=1S/C15H28N4/c1-11-7-10-18-19(11)13-8-9-17-15(14(13)16)12-5-3-2-4-6-12/h8,11-12,14-15,17-18H,2-7,9-10,16H2,1H3
InChIKeyJOEUKIPGDDVSHU-UHFFFAOYSA-N
XLogP1.35
TPSA53.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 51.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-4-(5-methylpyrazolidin-1-yl)-1,2,3,6-tetrahydropyridin-3-amine?
The IUPAC name of 2-cyclohexyl-4-(5-methylpyrazolidin-1-yl)-1,2,3,6-tetrahydropyridin-3-amine (CID 138645340) is 2-cyclohexyl-4-(5-methylpyrazolidin-1-yl)-1,2,3,6-tetrahydropyridin-3-amine.
What is the SMILES notation for 2-cyclohexyl-4-(5-methylpyrazolidin-1-yl)-1,2,3,6-tetrahydropyridin-3-amine?
The canonical SMILES for 2-cyclohexyl-4-(5-methylpyrazolidin-1-yl)-1,2,3,6-tetrahydropyridin-3-amine is CC1CCNN1C1=CCNC(C2CCCCC2)C1N.
What is the InChIKey of 2-cyclohexyl-4-(5-methylpyrazolidin-1-yl)-1,2,3,6-tetrahydropyridin-3-amine?
The InChIKey is JOEUKIPGDDVSHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-11-7-10-18-19(11)13-8-9-17-15(14(13)16)12-5-3-2-4-6-12/h8,11-12,14-15,17-18H,2-7,9-10,16H2,1H3.
What are the key properties of 2-cyclohexyl-4-(5-methylpyrazolidin-1-yl)-1,2,3,6-tetrahydropyridin-3-amine?
2-cyclohexyl-4-(5-methylpyrazolidin-1-yl)-1,2,3,6-tetrahydropyridin-3-amine has a molecular weight of 264.42 g/mol, XLogP of 1.35, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-4-(5-methylpyrazolidin-1-yl)-1,2,3,6-tetrahydropyridin-3-amine is sourced from PubChem (CID 138645340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).