3-propyl-1-pyridin-4-ylhexan-2-amine

C14H24N2 — CID 82987506

IUPAC3-propyl-1-pyridin-4-ylhexan-2-amine
SMILESCCCC(CCC)C(N)Cc1ccncc1
InChIInChI=1S/C14H24N2/c1-3-5-13(6-4-2)14(15)11-12-7-9-16-10-8-12/h7-10,13-14H,3-6,11,15H2,1-2H3
InChIKeyDGYROABMEKRDMK-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.17
Rot. Bonds7

About 3-propyl-1-pyridin-4-ylhexan-2-amine

3-propyl-1-pyridin-4-ylhexan-2-amine (PubChem CID 82987506) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 3-propyl-1-pyridin-4-ylhexan-2-amine.

Molecular Properties

Compound Name3-propyl-1-pyridin-4-ylhexan-2-amine
PubChem CID82987506
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name3-propyl-1-pyridin-4-ylhexan-2-amine
SMILESCCCC(CCC)C(N)Cc1ccncc1
InChIInChI=1S/C14H24N2/c1-3-5-13(6-4-2)14(15)11-12-7-9-16-10-8-12/h7-10,13-14H,3-6,11,15H2,1-2H3
InChIKeyDGYROABMEKRDMK-UHFFFAOYSA-N
XLogP3.17
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-propyl-1-pyridin-4-ylhexan-2-amine?
The IUPAC name of 3-propyl-1-pyridin-4-ylhexan-2-amine (CID 82987506) is 3-propyl-1-pyridin-4-ylhexan-2-amine.
What is the SMILES notation for 3-propyl-1-pyridin-4-ylhexan-2-amine?
The canonical SMILES for 3-propyl-1-pyridin-4-ylhexan-2-amine is CCCC(CCC)C(N)Cc1ccncc1.
What is the InChIKey of 3-propyl-1-pyridin-4-ylhexan-2-amine?
The InChIKey is DGYROABMEKRDMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-3-5-13(6-4-2)14(15)11-12-7-9-16-10-8-12/h7-10,13-14H,3-6,11,15H2,1-2H3.
What are the key properties of 3-propyl-1-pyridin-4-ylhexan-2-amine?
3-propyl-1-pyridin-4-ylhexan-2-amine has a molecular weight of 220.36 g/mol, XLogP of 3.17, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propyl-1-pyridin-4-ylhexan-2-amine is sourced from PubChem (CID 82987506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).