4-propyl-2,3,4,5-tetrahydropyridin-6-amine

C8H16N2 — CID 10655660

IUPAC4-propyl-2,3,4,5-tetrahydropyridin-6-amine
SMILESCCCC1CCN=C(N)C1
InChIInChI=1S/C8H16N2/c1-2-3-7-4-5-10-8(9)6-7/h7H,2-6H2,1H3,(H2,9,10)
InChIKeyMEFVVPMWEUFYGI-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.55
Rot. Bonds2

About 4-propyl-2,3,4,5-tetrahydropyridin-6-amine

4-propyl-2,3,4,5-tetrahydropyridin-6-amine (PubChem CID 10655660) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 4-propyl-2,3,4,5-tetrahydropyridin-6-amine.

Molecular Properties

Compound Name4-propyl-2,3,4,5-tetrahydropyridin-6-amine
PubChem CID10655660
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name4-propyl-2,3,4,5-tetrahydropyridin-6-amine
SMILESCCCC1CCN=C(N)C1
InChIInChI=1S/C8H16N2/c1-2-3-7-4-5-10-8(9)6-7/h7H,2-6H2,1H3,(H2,9,10)
InChIKeyMEFVVPMWEUFYGI-UHFFFAOYSA-N
XLogP1.55
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-propyl-2,3,4,5-tetrahydropyridin-6-amine?
The IUPAC name of 4-propyl-2,3,4,5-tetrahydropyridin-6-amine (CID 10655660) is 4-propyl-2,3,4,5-tetrahydropyridin-6-amine.
What is the SMILES notation for 4-propyl-2,3,4,5-tetrahydropyridin-6-amine?
The canonical SMILES for 4-propyl-2,3,4,5-tetrahydropyridin-6-amine is CCCC1CCN=C(N)C1.
What is the InChIKey of 4-propyl-2,3,4,5-tetrahydropyridin-6-amine?
The InChIKey is MEFVVPMWEUFYGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-2-3-7-4-5-10-8(9)6-7/h7H,2-6H2,1H3,(H2,9,10).
What are the key properties of 4-propyl-2,3,4,5-tetrahydropyridin-6-amine?
4-propyl-2,3,4,5-tetrahydropyridin-6-amine has a molecular weight of 140.23 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propyl-2,3,4,5-tetrahydropyridin-6-amine is sourced from PubChem (CID 10655660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).