5-(2,3-dihydropyridin-2-yl)pentan-2-amine

C10H18N2 — CID 67896760

IUPAC5-(2,3-dihydropyridin-2-yl)pentan-2-amine
SMILESCC(N)CCCC1CC=CC=N1
InChIInChI=1S/C10H18N2/c1-9(11)5-4-7-10-6-2-3-8-12-10/h2-3,8-10H,4-7,11H2,1H3
InChIKeyJKEVZUHJODBYGR-UHFFFAOYSA-N
MW166.27 g/mol
LogP1.90
Rot. Bonds4

About 5-(2,3-dihydropyridin-2-yl)pentan-2-amine

5-(2,3-dihydropyridin-2-yl)pentan-2-amine (PubChem CID 67896760) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 5-(2,3-dihydropyridin-2-yl)pentan-2-amine.

Molecular Properties

Compound Name5-(2,3-dihydropyridin-2-yl)pentan-2-amine
PubChem CID67896760
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name5-(2,3-dihydropyridin-2-yl)pentan-2-amine
SMILESCC(N)CCCC1CC=CC=N1
InChIInChI=1S/C10H18N2/c1-9(11)5-4-7-10-6-2-3-8-12-10/h2-3,8-10H,4-7,11H2,1H3
InChIKeyJKEVZUHJODBYGR-UHFFFAOYSA-N
XLogP1.90
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(2,3-dihydropyridin-2-yl)pentan-2-amine?
The IUPAC name of 5-(2,3-dihydropyridin-2-yl)pentan-2-amine (CID 67896760) is 5-(2,3-dihydropyridin-2-yl)pentan-2-amine.
What is the SMILES notation for 5-(2,3-dihydropyridin-2-yl)pentan-2-amine?
The canonical SMILES for 5-(2,3-dihydropyridin-2-yl)pentan-2-amine is CC(N)CCCC1CC=CC=N1.
What is the InChIKey of 5-(2,3-dihydropyridin-2-yl)pentan-2-amine?
The InChIKey is JKEVZUHJODBYGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-9(11)5-4-7-10-6-2-3-8-12-10/h2-3,8-10H,4-7,11H2,1H3.
What are the key properties of 5-(2,3-dihydropyridin-2-yl)pentan-2-amine?
5-(2,3-dihydropyridin-2-yl)pentan-2-amine has a molecular weight of 166.27 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3-dihydropyridin-2-yl)pentan-2-amine is sourced from PubChem (CID 67896760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).