1-[2,6-di(propan-2-yl)quinolin-4-yl]-N-methylmethanamine

C17H24N2 — CID 82448355

IUPAC1-[2,6-di(propan-2-yl)quinolin-4-yl]-N-methylmethanamine
SMILESCNCc1cc(C(C)C)nc2ccc(C(C)C)cc12
InChIInChI=1S/C17H24N2/c1-11(2)13-6-7-16-15(8-13)14(10-18-5)9-17(19-16)12(3)4/h6-9,11-12,18H,10H2,1-5H3
InChIKeyYJXIBSRANFQSOZ-UHFFFAOYSA-N
MW256.39 g/mol
LogP4.20
Rot. Bonds4

About 1-[2,6-di(propan-2-yl)quinolin-4-yl]-N-methylmethanamine

1-[2,6-di(propan-2-yl)quinolin-4-yl]-N-methylmethanamine (PubChem CID 82448355) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 1-[2,6-di(propan-2-yl)quinolin-4-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2,6-di(propan-2-yl)quinolin-4-yl]-N-methylmethanamine
PubChem CID82448355
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC Name1-[2,6-di(propan-2-yl)quinolin-4-yl]-N-methylmethanamine
SMILESCNCc1cc(C(C)C)nc2ccc(C(C)C)cc12
InChIInChI=1S/C17H24N2/c1-11(2)13-6-7-16-15(8-13)14(10-18-5)9-17(19-16)12(3)4/h6-9,11-12,18H,10H2,1-5H3
InChIKeyYJXIBSRANFQSOZ-UHFFFAOYSA-N
XLogP4.20
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-(6-methyl-2-propan-2-ylquinolin-4-yl)methanamine
CID 82448157
2,6-di(propan-2-yl)quinoline-4-carbothioamide
CID 82448365
1-(6-chloro-2-methylquinolin-4-yl)-N-methylmethanamine
CID 82449106
N,4-dimethyl-6-propan-2-ylquinolin-2-amine
CID 84621948
N-[(6-methoxy-2-propan-2-ylquinolin-4-yl)methyl]cyclopentanamine
CID 82449789
N-methyl-1-(5-propan-2-yl-1,3-benzoxazol-2-yl)methanamine
CID 82230268
2-(2-propan-2-ylquinolin-4-yl)acetic acid
CID 82081543
N,6-dimethyl-2-propan-2-ylquinolin-4-amine
CID 62202007
2,8-di(propan-2-yl)phenazine
CID 70800003
N-methyl-2-phenyl-6-propan-2-ylquinolin-4-amine
CID 63481504
6-fluoro-N-methyl-2-propan-2-ylquinolin-4-amine
CID 62202391
4-acetamido-6-propan-2-ylquinoline-2-carboxylic acid
CID 84641744

Frequently Asked Questions

What is the IUPAC name of 1-[2,6-di(propan-2-yl)quinolin-4-yl]-N-methylmethanamine?
The IUPAC name of 1-[2,6-di(propan-2-yl)quinolin-4-yl]-N-methylmethanamine (CID 82448355) is 1-[2,6-di(propan-2-yl)quinolin-4-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[2,6-di(propan-2-yl)quinolin-4-yl]-N-methylmethanamine?
The canonical SMILES for 1-[2,6-di(propan-2-yl)quinolin-4-yl]-N-methylmethanamine is CNCc1cc(C(C)C)nc2ccc(C(C)C)cc12.
What is the InChIKey of 1-[2,6-di(propan-2-yl)quinolin-4-yl]-N-methylmethanamine?
The InChIKey is YJXIBSRANFQSOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-11(2)13-6-7-16-15(8-13)14(10-18-5)9-17(19-16)12(3)4/h6-9,11-12,18H,10H2,1-5H3.
What are the key properties of 1-[2,6-di(propan-2-yl)quinolin-4-yl]-N-methylmethanamine?
1-[2,6-di(propan-2-yl)quinolin-4-yl]-N-methylmethanamine has a molecular weight of 256.39 g/mol, XLogP of 4.20, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2,6-di(propan-2-yl)quinolin-4-yl]-N-methylmethanamine is sourced from PubChem (CID 82448355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).