6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine

C16H29N3 — CID 103936956

IUPAC6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine
SMILESCCCCN(CCCC)c1ccc([C@H](N)CC)nc1
InChIInChI=1S/C16H29N3/c1-4-7-11-19(12-8-5-2)14-9-10-16(18-13-14)15(17)6-3/h9-10,13,15H,4-8,11-12,17H2,1-3H3/t15-/m1/s1
InChIKeyQUGPRZNOPIOKQV-OAHLLOKOSA-N
MW263.43 g/mol
LogP3.90
Rot. Bonds9

About 6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine

6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine (PubChem CID 103936956) has the molecular formula C16H29N3 and a molecular weight of 263.43 g/mol. Its IUPAC name is 6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine.

Molecular Properties

Compound Name6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine
PubChem CID103936956
Molecular FormulaC16H29N3
Molecular Weight263.43 g/mol
Exact Mass263.24
IUPAC Name6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine
SMILESCCCCN(CCCC)c1ccc([C@H](N)CC)nc1
InChIInChI=1S/C16H29N3/c1-4-7-11-19(12-8-5-2)14-9-10-16(18-13-14)15(17)6-3/h9-10,13,15H,4-8,11-12,17H2,1-3H3/t15-/m1/s1
InChIKeyQUGPRZNOPIOKQV-OAHLLOKOSA-N
XLogP3.90
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine?
The IUPAC name of 6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine (CID 103936956) is 6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine.
What is the SMILES notation for 6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine?
The canonical SMILES for 6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine is CCCCN(CCCC)c1ccc([C@H](N)CC)nc1.
What is the InChIKey of 6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine?
The InChIKey is QUGPRZNOPIOKQV-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H29N3/c1-4-7-11-19(12-8-5-2)14-9-10-16(18-13-14)15(17)6-3/h9-10,13,15H,4-8,11-12,17H2,1-3H3/t15-/m1/s1.
What are the key properties of 6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine?
6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine has a molecular weight of 263.43 g/mol, XLogP of 3.90, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine is sourced from PubChem (CID 103936956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).