(6-benzyl-3-pyridinyl)methanamine;ethane

C15H20N2 — CID 54242306

IUPAC(6-benzyl-3-pyridinyl)methanamine;ethane
SMILESCC.NCc1ccc(Cc2ccccc2)nc1
InChIInChI=1S/C13H14N2.C2H6/c14-9-12-6-7-13(15-10-12)8-11-4-2-1-3-5-11;1-2/h1-7,10H,8-9,14H2;1-2H3
InChIKeyQQWBVZXSFRICQU-UHFFFAOYSA-N
MW228.34 g/mol
LogP3.16
Rot. Bonds3

About (6-benzyl-3-pyridinyl)methanamine;ethane

(6-benzyl-3-pyridinyl)methanamine;ethane (PubChem CID 54242306) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is (6-benzyl-3-pyridinyl)methanamine;ethane.

Molecular Properties

Compound Name(6-benzyl-3-pyridinyl)methanamine;ethane
PubChem CID54242306
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name(6-benzyl-3-pyridinyl)methanamine;ethane
SMILESCC.NCc1ccc(Cc2ccccc2)nc1
InChIInChI=1S/C13H14N2.C2H6/c14-9-12-6-7-13(15-10-12)8-11-4-2-1-3-5-11;1-2/h1-7,10H,8-9,14H2;1-2H3
InChIKeyQQWBVZXSFRICQU-UHFFFAOYSA-N
XLogP3.16
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(6-benzyl-3-pyridinyl)ethanamine
CID 117001758
[6-(2-methylpropyl)-3-pyridinyl]methanamine
CID 53274665
[6-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-pyridinyl]methanamine
CID 176908126
ethane;phenylmethanamine;vanadium
CID 158602574
1,4-dibenzylbenzene;ethane
CID 91406396
1-benzyl-4-[(4-benzylphenyl)methyl]benzene;1,4-dibenzylbenzene;ethane
CID 158067654
6-benzylpyridine-3-carboxylic acid;1-(6-benzyl-3-pyridinyl)ethanone
CID 161401140
benzylbenzene;ethane;methanamine
CID 54117827
phenylmethanamine
CID 19864074
(6-methyl-3-pyridinyl)methanamine;hydrobromide
CID 133057273
[6-(2-propan-2-ylphenoxy)-3-pyridinyl]methanamine
CID 16781989
2,5-bis[(3-methoxyphenyl)methyl]pyridine
CID 91067305

Frequently Asked Questions

What is the IUPAC name of (6-benzyl-3-pyridinyl)methanamine;ethane?
The IUPAC name of (6-benzyl-3-pyridinyl)methanamine;ethane (CID 54242306) is (6-benzyl-3-pyridinyl)methanamine;ethane.
What is the SMILES notation for (6-benzyl-3-pyridinyl)methanamine;ethane?
The canonical SMILES for (6-benzyl-3-pyridinyl)methanamine;ethane is CC.NCc1ccc(Cc2ccccc2)nc1.
What is the InChIKey of (6-benzyl-3-pyridinyl)methanamine;ethane?
The InChIKey is QQWBVZXSFRICQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2.C2H6/c14-9-12-6-7-13(15-10-12)8-11-4-2-1-3-5-11;1-2/h1-7,10H,8-9,14H2;1-2H3.
What are the key properties of (6-benzyl-3-pyridinyl)methanamine;ethane?
(6-benzyl-3-pyridinyl)methanamine;ethane has a molecular weight of 228.34 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-benzyl-3-pyridinyl)methanamine;ethane is sourced from PubChem (CID 54242306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).