4-methyl-N-(3-piperidin-1-ylpropyl)quinolin-2-amine

C18H25N3 — CID 19078262

IUPAC4-methyl-N-(3-piperidin-1-ylpropyl)quinolin-2-amine
SMILESCc1cc(NCCCN2CCCCC2)nc2ccccc12
InChIInChI=1S/C18H25N3/c1-15-14-18(20-17-9-4-3-8-16(15)17)19-10-7-13-21-11-5-2-6-12-21/h3-4,8-9,14H,2,5-7,10-13H2,1H3,(H,19,20)
InChIKeyLGVUTNNEPPKZEF-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.83
Rot. Bonds5

About 4-methyl-N-(3-piperidin-1-ylpropyl)quinolin-2-amine

4-methyl-N-(3-piperidin-1-ylpropyl)quinolin-2-amine (PubChem CID 19078262) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is 4-methyl-N-(3-piperidin-1-ylpropyl)quinolin-2-amine.

Molecular Properties

Compound Name4-methyl-N-(3-piperidin-1-ylpropyl)quinolin-2-amine
PubChem CID19078262
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name4-methyl-N-(3-piperidin-1-ylpropyl)quinolin-2-amine
SMILESCc1cc(NCCCN2CCCCC2)nc2ccccc12
InChIInChI=1S/C18H25N3/c1-15-14-18(20-17-9-4-3-8-16(15)17)19-10-7-13-21-11-5-2-6-12-21/h3-4,8-9,14H,2,5-7,10-13H2,1H3,(H,19,20)
InChIKeyLGVUTNNEPPKZEF-UHFFFAOYSA-N
XLogP3.83
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(3-piperidin-1-ylpropyl)quinolin-2-amine?
The IUPAC name of 4-methyl-N-(3-piperidin-1-ylpropyl)quinolin-2-amine (CID 19078262) is 4-methyl-N-(3-piperidin-1-ylpropyl)quinolin-2-amine.
What is the SMILES notation for 4-methyl-N-(3-piperidin-1-ylpropyl)quinolin-2-amine?
The canonical SMILES for 4-methyl-N-(3-piperidin-1-ylpropyl)quinolin-2-amine is Cc1cc(NCCCN2CCCCC2)nc2ccccc12.
What is the InChIKey of 4-methyl-N-(3-piperidin-1-ylpropyl)quinolin-2-amine?
The InChIKey is LGVUTNNEPPKZEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-15-14-18(20-17-9-4-3-8-16(15)17)19-10-7-13-21-11-5-2-6-12-21/h3-4,8-9,14H,2,5-7,10-13H2,1H3,(H,19,20).
What are the key properties of 4-methyl-N-(3-piperidin-1-ylpropyl)quinolin-2-amine?
4-methyl-N-(3-piperidin-1-ylpropyl)quinolin-2-amine has a molecular weight of 283.42 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(3-piperidin-1-ylpropyl)quinolin-2-amine is sourced from PubChem (CID 19078262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).