2-butan-2-yl-6-methoxyquinoline

C14H17NO — CID 142826325

IUPAC2-butan-2-yl-6-methoxyquinoline
SMILESCCC(C)c1ccc2cc(OC)ccc2n1
InChIInChI=1S/C14H17NO/c1-4-10(2)13-7-5-11-9-12(16-3)6-8-14(11)15-13/h5-10H,4H2,1-3H3
InChIKeyQRPYZHSNMONSNK-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.76
Rot. Bonds3

About 2-butan-2-yl-6-methoxyquinoline

2-butan-2-yl-6-methoxyquinoline (PubChem CID 142826325) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is 2-butan-2-yl-6-methoxyquinoline.

Molecular Properties

Compound Name2-butan-2-yl-6-methoxyquinoline
PubChem CID142826325
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name2-butan-2-yl-6-methoxyquinoline
SMILESCCC(C)c1ccc2cc(OC)ccc2n1
InChIInChI=1S/C14H17NO/c1-4-10(2)13-7-5-11-9-12(16-3)6-8-14(11)15-13/h5-10H,4H2,1-3H3
InChIKeyQRPYZHSNMONSNK-UHFFFAOYSA-N
XLogP3.76
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-(6-methoxyquinolin-2-yl)-2-phenylethanamine
CID 146479702
(6-methoxyquinolin-2-yl)methanamine;dihydrochloride
CID 47002728
6-methoxy-2-(4-propoxyphenyl)quinoline
CID 102441525
2-(3,5-dimethylphenyl)-6-methoxyquinoline
CID 58871188
N-[(1S)-1-(6-methoxyquinolin-2-yl)-2-phenylethyl]acetamide
CID 138978300
6-methoxy-2-naphthalen-1-ylquinoline
CID 164679227
N-[(2R)-2-hydroxypropyl]-6-methoxy-N-methylquinoline-2-carboxamide
CID 95972027
4-(6-methoxyquinolin-2-yl)-N-methylaniline
CID 46931568
3-(6-methoxyquinolin-2-yl)-N,N-dimethylpropan-1-amine
CID 23204412
(6-methoxyquinolin-2-yl)methylphosphonic acid
CID 67774367
6-methoxy-2-(6-octoxynaphthalen-2-yl)quinoline
CID 122228076
6-methoxy-2-(2,3,5-trimethylphenyl)quinoline
CID 58871166

Frequently Asked Questions

What is the IUPAC name of 2-butan-2-yl-6-methoxyquinoline?
The IUPAC name of 2-butan-2-yl-6-methoxyquinoline (CID 142826325) is 2-butan-2-yl-6-methoxyquinoline.
What is the SMILES notation for 2-butan-2-yl-6-methoxyquinoline?
The canonical SMILES for 2-butan-2-yl-6-methoxyquinoline is CCC(C)c1ccc2cc(OC)ccc2n1.
What is the InChIKey of 2-butan-2-yl-6-methoxyquinoline?
The InChIKey is QRPYZHSNMONSNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-4-10(2)13-7-5-11-9-12(16-3)6-8-14(11)15-13/h5-10H,4H2,1-3H3.
What are the key properties of 2-butan-2-yl-6-methoxyquinoline?
2-butan-2-yl-6-methoxyquinoline has a molecular weight of 215.30 g/mol, XLogP of 3.76, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butan-2-yl-6-methoxyquinoline is sourced from PubChem (CID 142826325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).