6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylpyridin-3-amine

C15H17N3 — CID 62476681

IUPAC6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylpyridin-3-amine
SMILESCc1cc(N)cnc1N1CCc2ccccc2C1
InChIInChI=1S/C15H17N3/c1-11-8-14(16)9-17-15(11)18-7-6-12-4-2-3-5-13(12)10-18/h2-5,8-9H,6-7,10,16H2,1H3
InChIKeyNBUSAWFUCQBRKE-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.53
Rot. Bonds1

About 6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylpyridin-3-amine

6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylpyridin-3-amine (PubChem CID 62476681) has the molecular formula C15H17N3 and a molecular weight of 239.32 g/mol. Its IUPAC name is 6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylpyridin-3-amine.

Molecular Properties

Compound Name6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylpyridin-3-amine
PubChem CID62476681
Molecular FormulaC15H17N3
Molecular Weight239.32 g/mol
Exact Mass239.14
IUPAC Name6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylpyridin-3-amine
SMILESCc1cc(N)cnc1N1CCc2ccccc2C1
InChIInChI=1S/C15H17N3/c1-11-8-14(16)9-17-15(11)18-7-6-12-4-2-3-5-13(12)10-18/h2-5,8-9H,6-7,10,16H2,1H3
InChIKeyNBUSAWFUCQBRKE-UHFFFAOYSA-N
XLogP2.53
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylpyridine-3-carbonitrile
CID 102545053
5-amino-2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridine-3-carboxylic acid
CID 82487874
1-[6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methyl-3-pyridinyl]propan-2-amine
CID 80638539
1-[6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methyl-3-pyridinyl]propan-1-ol
CID 102545058
4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-methylthieno[2,3-d]pyrimidine
CID 133407195
5-methyl-2-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyridin-3-amine
CID 66279774
3-[5-(chloromethyl)-3-methyl-2-pyridinyl]-1,2,4,5-tetrahydro-3-benzazepine
CID 80628870
N-methyl-1-[5-methyl-6-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)-3-pyridinyl]methanamine
CID 80637891
2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-3-amine
CID 16783390
5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylaniline
CID 62911258
6-(3,4-dihydro-1H-isoquinolin-2-yl)-4-N-methylpyrimidine-4,5-diamine
CID 19135043
6-(3,4-dihydro-1H-isoquinolin-2-yl)-2,5-dimethylpyrimidin-4-amine
CID 80767136

Frequently Asked Questions

What is the IUPAC name of 6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylpyridin-3-amine?
The IUPAC name of 6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylpyridin-3-amine (CID 62476681) is 6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylpyridin-3-amine.
What is the SMILES notation for 6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylpyridin-3-amine?
The canonical SMILES for 6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylpyridin-3-amine is Cc1cc(N)cnc1N1CCc2ccccc2C1.
What is the InChIKey of 6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylpyridin-3-amine?
The InChIKey is NBUSAWFUCQBRKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3/c1-11-8-14(16)9-17-15(11)18-7-6-12-4-2-3-5-13(12)10-18/h2-5,8-9H,6-7,10,16H2,1H3.
What are the key properties of 6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylpyridin-3-amine?
6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylpyridin-3-amine has a molecular weight of 239.32 g/mol, XLogP of 2.53, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylpyridin-3-amine is sourced from PubChem (CID 62476681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).