8-chloro-6-methyl-N,2-dipropylquinolin-4-amine

C16H21ClN2 — CID 63479380

IUPAC8-chloro-6-methyl-N,2-dipropylquinolin-4-amine
SMILESCCCNc1cc(CCC)nc2c(Cl)cc(C)cc12
InChIInChI=1S/C16H21ClN2/c1-4-6-12-10-15(18-7-5-2)13-8-11(3)9-14(17)16(13)19-12/h8-10H,4-7H2,1-3H3,(H,18,19)
InChIKeyJJBKZHKRCQZLKI-UHFFFAOYSA-N
MW276.81 g/mol
LogP4.97
Rot. Bonds5

About 8-chloro-6-methyl-N,2-dipropylquinolin-4-amine

8-chloro-6-methyl-N,2-dipropylquinolin-4-amine (PubChem CID 63479380) has the molecular formula C16H21ClN2 and a molecular weight of 276.81 g/mol. Its IUPAC name is 8-chloro-6-methyl-N,2-dipropylquinolin-4-amine.

Molecular Properties

Compound Name8-chloro-6-methyl-N,2-dipropylquinolin-4-amine
PubChem CID63479380
Molecular FormulaC16H21ClN2
Molecular Weight276.81 g/mol
Exact Mass276.14
IUPAC Name8-chloro-6-methyl-N,2-dipropylquinolin-4-amine
SMILESCCCNc1cc(CCC)nc2c(Cl)cc(C)cc12
InChIInChI=1S/C16H21ClN2/c1-4-6-12-10-15(18-7-5-2)13-8-11(3)9-14(17)16(13)19-12/h8-10H,4-7H2,1-3H3,(H,18,19)
InChIKeyJJBKZHKRCQZLKI-UHFFFAOYSA-N
XLogP4.97
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.81
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-6-methyl-N,2-dipropylquinolin-4-amine?
The IUPAC name of 8-chloro-6-methyl-N,2-dipropylquinolin-4-amine (CID 63479380) is 8-chloro-6-methyl-N,2-dipropylquinolin-4-amine.
What is the SMILES notation for 8-chloro-6-methyl-N,2-dipropylquinolin-4-amine?
The canonical SMILES for 8-chloro-6-methyl-N,2-dipropylquinolin-4-amine is CCCNc1cc(CCC)nc2c(Cl)cc(C)cc12.
What is the InChIKey of 8-chloro-6-methyl-N,2-dipropylquinolin-4-amine?
The InChIKey is JJBKZHKRCQZLKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21ClN2/c1-4-6-12-10-15(18-7-5-2)13-8-11(3)9-14(17)16(13)19-12/h8-10H,4-7H2,1-3H3,(H,18,19).
What are the key properties of 8-chloro-6-methyl-N,2-dipropylquinolin-4-amine?
8-chloro-6-methyl-N,2-dipropylquinolin-4-amine has a molecular weight of 276.81 g/mol, XLogP of 4.97, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-6-methyl-N,2-dipropylquinolin-4-amine is sourced from PubChem (CID 63479380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).