3-(2,8-dimethylquinolin-4-yl)propan-1-amine

C14H18N2 — CID 82576634

IUPAC3-(2,8-dimethylquinolin-4-yl)propan-1-amine
SMILESCc1cc(CCCN)c2cccc(C)c2n1
InChIInChI=1S/C14H18N2/c1-10-5-3-7-13-12(6-4-8-15)9-11(2)16-14(10)13/h3,5,7,9H,4,6,8,15H2,1-2H3
InChIKeyGJRHZXREVKVWBT-UHFFFAOYSA-N
MW214.31 g/mol
LogP2.74
Rot. Bonds3

About 3-(2,8-dimethylquinolin-4-yl)propan-1-amine

3-(2,8-dimethylquinolin-4-yl)propan-1-amine (PubChem CID 82576634) has the molecular formula C14H18N2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 3-(2,8-dimethylquinolin-4-yl)propan-1-amine.

Molecular Properties

Compound Name3-(2,8-dimethylquinolin-4-yl)propan-1-amine
PubChem CID82576634
Molecular FormulaC14H18N2
Molecular Weight214.31 g/mol
Exact Mass214.15
IUPAC Name3-(2,8-dimethylquinolin-4-yl)propan-1-amine
SMILESCc1cc(CCCN)c2cccc(C)c2n1
InChIInChI=1S/C14H18N2/c1-10-5-3-7-13-12(6-4-8-15)9-11(2)16-14(10)13/h3,5,7,9H,4,6,8,15H2,1-2H3
InChIKeyGJRHZXREVKVWBT-UHFFFAOYSA-N
XLogP2.74
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,8-dimethylquinolin-4-yl)acetic acid
CID 82447836
N-[(2,8-dimethylquinolin-4-yl)methyl]ethanamine
CID 82447822
4-(8-fluoro-6-iodo-2-methylquinolin-4-yl)butan-1-amine
CID 82577827
3-(4-methyl-1,3-benzothiazol-2-yl)propan-1-amine
CID 39106914
2-(6-chloro-2,8-dimethylquinolin-4-yl)ethanamine
CID 82575608
(4,8-dimethylquinolin-2-yl)methanamine
CID 82573614
4-(5,8-difluoro-2-methylquinolin-4-yl)butan-1-amine
CID 82577793
4-(2,6-dimethylquinolin-4-yl)butan-1-amine
CID 82577777
(8-methyl-2-propan-2-ylquinolin-4-yl)methanamine
CID 82447883
3-(2-fluoro-3-methylphenyl)propan-1-amine
CID 70348406
3-(6,7-dimethoxy-2-methylquinolin-4-yl)propan-1-amine
CID 82576667
(8-fluoro-2-methylquinolin-4-yl)methanethiol
CID 82448814

Frequently Asked Questions

What is the IUPAC name of 3-(2,8-dimethylquinolin-4-yl)propan-1-amine?
The IUPAC name of 3-(2,8-dimethylquinolin-4-yl)propan-1-amine (CID 82576634) is 3-(2,8-dimethylquinolin-4-yl)propan-1-amine.
What is the SMILES notation for 3-(2,8-dimethylquinolin-4-yl)propan-1-amine?
The canonical SMILES for 3-(2,8-dimethylquinolin-4-yl)propan-1-amine is Cc1cc(CCCN)c2cccc(C)c2n1.
What is the InChIKey of 3-(2,8-dimethylquinolin-4-yl)propan-1-amine?
The InChIKey is GJRHZXREVKVWBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2/c1-10-5-3-7-13-12(6-4-8-15)9-11(2)16-14(10)13/h3,5,7,9H,4,6,8,15H2,1-2H3.
What are the key properties of 3-(2,8-dimethylquinolin-4-yl)propan-1-amine?
3-(2,8-dimethylquinolin-4-yl)propan-1-amine has a molecular weight of 214.31 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,8-dimethylquinolin-4-yl)propan-1-amine is sourced from PubChem (CID 82576634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).