[3-[(dimethylamino)methyl]-2-pyridinyl]methanamine

C9H15N3 — CID 62893638

IUPAC[3-[(dimethylamino)methyl]-2-pyridinyl]methanamine
SMILESCN(C)Cc1cccnc1CN
InChIInChI=1S/C9H15N3/c1-12(2)7-8-4-3-5-11-9(8)6-10/h3-5H,6-7,10H2,1-2H3
InChIKeyXYKPDTVSNRXYHX-UHFFFAOYSA-N
MW165.24 g/mol
LogP0.60
Rot. Bonds3

About [3-[(dimethylamino)methyl]-2-pyridinyl]methanamine

[3-[(dimethylamino)methyl]-2-pyridinyl]methanamine (PubChem CID 62893638) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is [3-[(dimethylamino)methyl]-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[3-[(dimethylamino)methyl]-2-pyridinyl]methanamine
PubChem CID62893638
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name[3-[(dimethylamino)methyl]-2-pyridinyl]methanamine
SMILESCN(C)Cc1cccnc1CN
InChIInChI=1S/C9H15N3/c1-12(2)7-8-4-3-5-11-9(8)6-10/h3-5H,6-7,10H2,1-2H3
InChIKeyXYKPDTVSNRXYHX-UHFFFAOYSA-N
XLogP0.60
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-1-[2-(trimethylsilylmethyl)-3-pyridinyl]methanamine
CID 13058277
[3-[[(2-fluorophenyl)methyl-methylamino]methyl]-2-pyridinyl]methanamine
CID 62895513
[3-[[methyl(1,3-thiazol-4-ylmethyl)amino]methyl]-2-pyridinyl]methanamine
CID 62895863
[3-[[(3-fluorophenyl)methyl-methylamino]methyl]-2-pyridinyl]methanamine
CID 62894998
2-[[2-(aminomethyl)-3-pyridinyl]methyl-methylamino]-N,N-diethylacetamide
CID 62893303
[3-[[(3-bromophenyl)methyl-methylamino]methyl]-2-pyridinyl]methanamine
CID 62893469
1-[1-[[2-(aminomethyl)-3-pyridinyl]methyl]piperidin-4-yl]-N,N-dimethylmethanamine
CID 62893815
N-[[2-(aminomethyl)-3-pyridinyl]methyl]-N-propan-2-ylpentan-1-amine
CID 55128300
[2-[(dimethylamino)methyl]phenyl]methanamine
CID 4962718
N-[[2-(aminomethyl)-3-pyridinyl]methyl]-N-(thiophen-2-ylmethyl)ethanamine
CID 62895005
N,N-dimethyl-1-(3-methyl-2-pyridinyl)methanamine
CID 20666322
N-[[2-(aminomethyl)-3-pyridinyl]methyl]-N-(oxolan-2-ylmethyl)ethanamine
CID 62894833

Frequently Asked Questions

What is the IUPAC name of [3-[(dimethylamino)methyl]-2-pyridinyl]methanamine?
The IUPAC name of [3-[(dimethylamino)methyl]-2-pyridinyl]methanamine (CID 62893638) is [3-[(dimethylamino)methyl]-2-pyridinyl]methanamine.
What is the SMILES notation for [3-[(dimethylamino)methyl]-2-pyridinyl]methanamine?
The canonical SMILES for [3-[(dimethylamino)methyl]-2-pyridinyl]methanamine is CN(C)Cc1cccnc1CN.
What is the InChIKey of [3-[(dimethylamino)methyl]-2-pyridinyl]methanamine?
The InChIKey is XYKPDTVSNRXYHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-12(2)7-8-4-3-5-11-9(8)6-10/h3-5H,6-7,10H2,1-2H3.
What are the key properties of [3-[(dimethylamino)methyl]-2-pyridinyl]methanamine?
[3-[(dimethylamino)methyl]-2-pyridinyl]methanamine has a molecular weight of 165.24 g/mol, XLogP of 0.60, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(dimethylamino)methyl]-2-pyridinyl]methanamine is sourced from PubChem (CID 62893638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).