1-(7,8-dichloro-4-methylquinolin-2-yl)-2-methylpropan-2-amine

C14H16Cl2N2 — CID 82577306

IUPAC1-(7,8-dichloro-4-methylquinolin-2-yl)-2-methylpropan-2-amine
SMILESCc1cc(CC(C)(C)N)nc2c(Cl)c(Cl)ccc12
InChIInChI=1S/C14H16Cl2N2/c1-8-6-9(7-14(2,3)17)18-13-10(8)4-5-11(15)12(13)16/h4-6H,7,17H2,1-3H3
InChIKeyWNPVYPPFNMJKJI-UHFFFAOYSA-N
MW283.20 g/mol
LogP4.13
Rot. Bonds2

About 1-(7,8-dichloro-4-methylquinolin-2-yl)-2-methylpropan-2-amine

1-(7,8-dichloro-4-methylquinolin-2-yl)-2-methylpropan-2-amine (PubChem CID 82577306) has the molecular formula C14H16Cl2N2 and a molecular weight of 283.20 g/mol. Its IUPAC name is 1-(7,8-dichloro-4-methylquinolin-2-yl)-2-methylpropan-2-amine.

Molecular Properties

Compound Name1-(7,8-dichloro-4-methylquinolin-2-yl)-2-methylpropan-2-amine
PubChem CID82577306
Molecular FormulaC14H16Cl2N2
Molecular Weight283.20 g/mol
Exact Mass282.07
IUPAC Name1-(7,8-dichloro-4-methylquinolin-2-yl)-2-methylpropan-2-amine
SMILESCc1cc(CC(C)(C)N)nc2c(Cl)c(Cl)ccc12
InChIInChI=1S/C14H16Cl2N2/c1-8-6-9(7-14(2,3)17)18-13-10(8)4-5-11(15)12(13)16/h4-6H,7,17H2,1-3H3
InChIKeyWNPVYPPFNMJKJI-UHFFFAOYSA-N
XLogP4.13
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.20
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(7,8-dichloro-4-methylquinolin-2-yl)-2-methylpropan-2-amine?
The IUPAC name of 1-(7,8-dichloro-4-methylquinolin-2-yl)-2-methylpropan-2-amine (CID 82577306) is 1-(7,8-dichloro-4-methylquinolin-2-yl)-2-methylpropan-2-amine.
What is the SMILES notation for 1-(7,8-dichloro-4-methylquinolin-2-yl)-2-methylpropan-2-amine?
The canonical SMILES for 1-(7,8-dichloro-4-methylquinolin-2-yl)-2-methylpropan-2-amine is Cc1cc(CC(C)(C)N)nc2c(Cl)c(Cl)ccc12.
What is the InChIKey of 1-(7,8-dichloro-4-methylquinolin-2-yl)-2-methylpropan-2-amine?
The InChIKey is WNPVYPPFNMJKJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16Cl2N2/c1-8-6-9(7-14(2,3)17)18-13-10(8)4-5-11(15)12(13)16/h4-6H,7,17H2,1-3H3.
What are the key properties of 1-(7,8-dichloro-4-methylquinolin-2-yl)-2-methylpropan-2-amine?
1-(7,8-dichloro-4-methylquinolin-2-yl)-2-methylpropan-2-amine has a molecular weight of 283.20 g/mol, XLogP of 4.13, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7,8-dichloro-4-methylquinolin-2-yl)-2-methylpropan-2-amine is sourced from PubChem (CID 82577306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).