(5-methyl-3-pyridinyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine

C17H20N2 — CID 115374693

IUPAC(5-methyl-3-pyridinyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
SMILESCc1cncc(C(N)C2CCc3ccccc3C2)c1
InChIInChI=1S/C17H20N2/c1-12-8-16(11-19-10-12)17(18)15-7-6-13-4-2-3-5-14(13)9-15/h2-5,8,10-11,15,17H,6-7,9,18H2,1H3
InChIKeyPAKZZVBNTAAQBB-UHFFFAOYSA-N
MW252.36 g/mol
LogP3.19
Rot. Bonds2

About (5-methyl-3-pyridinyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine

(5-methyl-3-pyridinyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine (PubChem CID 115374693) has the molecular formula C17H20N2 and a molecular weight of 252.36 g/mol. Its IUPAC name is (5-methyl-3-pyridinyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine.

Molecular Properties

Compound Name(5-methyl-3-pyridinyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
PubChem CID115374693
Molecular FormulaC17H20N2
Molecular Weight252.36 g/mol
Exact Mass252.16
IUPAC Name(5-methyl-3-pyridinyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
SMILESCc1cncc(C(N)C2CCc3ccccc3C2)c1
InChIInChI=1S/C17H20N2/c1-12-8-16(11-19-10-12)17(18)15-7-6-13-4-2-3-5-14(13)9-15/h2-5,8,10-11,15,17H,6-7,9,18H2,1H3
InChIKeyPAKZZVBNTAAQBB-UHFFFAOYSA-N
XLogP3.19
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,2,3,4-tetrahydronaphthalen-2-yl-(2,4,6-trimethylphenyl)methanamine
CID 107126496
(5-methyl-3-pyridinyl)-(4-propan-2-ylcyclohexyl)methanamine
CID 115374663
2,3-dihydro-1H-inden-5-yl(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 107126500
(5-fluoro-3-pyridinyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanol
CID 65410799
(5-methylfuran-2-yl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 107126532
(2-methylthiophen-3-yl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 102832882
(2,5-dibromo-4-methylphenyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 107126582
(2,4-difluoro-5-methylphenyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 107126557
[(3-fluoro-5-methylphenyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methyl]hydrazine
CID 105234720
2-(5-bromo-3-pyridinyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 104802640
2-(4-methylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 65404581
1-(3-fluoro-5-methylphenyl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 79697550

Frequently Asked Questions

What is the IUPAC name of (5-methyl-3-pyridinyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
The IUPAC name of (5-methyl-3-pyridinyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine (CID 115374693) is (5-methyl-3-pyridinyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine.
What is the SMILES notation for (5-methyl-3-pyridinyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
The canonical SMILES for (5-methyl-3-pyridinyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine is Cc1cncc(C(N)C2CCc3ccccc3C2)c1.
What is the InChIKey of (5-methyl-3-pyridinyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
The InChIKey is PAKZZVBNTAAQBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2/c1-12-8-16(11-19-10-12)17(18)15-7-6-13-4-2-3-5-14(13)9-15/h2-5,8,10-11,15,17H,6-7,9,18H2,1H3.
What are the key properties of (5-methyl-3-pyridinyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
(5-methyl-3-pyridinyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine has a molecular weight of 252.36 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-3-pyridinyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine is sourced from PubChem (CID 115374693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).