4-(3-propylpyrrolidin-1-yl)quinolin-7-amine

C16H21N3 — CID 103001744

IUPAC4-(3-propylpyrrolidin-1-yl)quinolin-7-amine
SMILESCCCC1CCN(c2ccnc3cc(N)ccc23)C1
InChIInChI=1S/C16H21N3/c1-2-3-12-7-9-19(11-12)16-6-8-18-15-10-13(17)4-5-14(15)16/h4-6,8,10,12H,2-3,7,9,11,17H2,1H3
InChIKeyLFDBTULRAHMZAL-UHFFFAOYSA-N
MW255.37 g/mol
LogP3.44
Rot. Bonds3

About 4-(3-propylpyrrolidin-1-yl)quinolin-7-amine

4-(3-propylpyrrolidin-1-yl)quinolin-7-amine (PubChem CID 103001744) has the molecular formula C16H21N3 and a molecular weight of 255.37 g/mol. Its IUPAC name is 4-(3-propylpyrrolidin-1-yl)quinolin-7-amine.

Molecular Properties

Compound Name4-(3-propylpyrrolidin-1-yl)quinolin-7-amine
PubChem CID103001744
Molecular FormulaC16H21N3
Molecular Weight255.37 g/mol
Exact Mass255.17
IUPAC Name4-(3-propylpyrrolidin-1-yl)quinolin-7-amine
SMILESCCCC1CCN(c2ccnc3cc(N)ccc23)C1
InChIInChI=1S/C16H21N3/c1-2-3-12-7-9-19(11-12)16-6-8-18-15-10-13(17)4-5-14(15)16/h4-6,8,10,12H,2-3,7,9,11,17H2,1H3
InChIKeyLFDBTULRAHMZAL-UHFFFAOYSA-N
XLogP3.44
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.37
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(3-propylpyrrolidin-1-yl)quinolin-7-amine?
The IUPAC name of 4-(3-propylpyrrolidin-1-yl)quinolin-7-amine (CID 103001744) is 4-(3-propylpyrrolidin-1-yl)quinolin-7-amine.
What is the SMILES notation for 4-(3-propylpyrrolidin-1-yl)quinolin-7-amine?
The canonical SMILES for 4-(3-propylpyrrolidin-1-yl)quinolin-7-amine is CCCC1CCN(c2ccnc3cc(N)ccc23)C1.
What is the InChIKey of 4-(3-propylpyrrolidin-1-yl)quinolin-7-amine?
The InChIKey is LFDBTULRAHMZAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c1-2-3-12-7-9-19(11-12)16-6-8-18-15-10-13(17)4-5-14(15)16/h4-6,8,10,12H,2-3,7,9,11,17H2,1H3.
What are the key properties of 4-(3-propylpyrrolidin-1-yl)quinolin-7-amine?
4-(3-propylpyrrolidin-1-yl)quinolin-7-amine has a molecular weight of 255.37 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-propylpyrrolidin-1-yl)quinolin-7-amine is sourced from PubChem (CID 103001744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).