N-[[2-(dimethylamino)-4-pyridinyl]methyl]-6-methylpyridin-2-amine

C14H18N4 — CID 133313823

IUPACN-[[2-(dimethylamino)-4-pyridinyl]methyl]-6-methylpyridin-2-amine
SMILESCc1cccc(NCc2ccnc(N(C)C)c2)n1
InChIInChI=1S/C14H18N4/c1-11-5-4-6-13(17-11)16-10-12-7-8-15-14(9-12)18(2)3/h4-9H,10H2,1-3H3,(H,16,17)
InChIKeyMHSNARQMYGAYPU-UHFFFAOYSA-N
MW242.33 g/mol
LogP2.46
Rot. Bonds4

About N-[[2-(dimethylamino)-4-pyridinyl]methyl]-6-methylpyridin-2-amine

N-[[2-(dimethylamino)-4-pyridinyl]methyl]-6-methylpyridin-2-amine (PubChem CID 133313823) has the molecular formula C14H18N4 and a molecular weight of 242.33 g/mol. Its IUPAC name is N-[[2-(dimethylamino)-4-pyridinyl]methyl]-6-methylpyridin-2-amine.

Molecular Properties

Compound NameN-[[2-(dimethylamino)-4-pyridinyl]methyl]-6-methylpyridin-2-amine
PubChem CID133313823
Molecular FormulaC14H18N4
Molecular Weight242.33 g/mol
Exact Mass242.15
IUPAC NameN-[[2-(dimethylamino)-4-pyridinyl]methyl]-6-methylpyridin-2-amine
SMILESCc1cccc(NCc2ccnc(N(C)C)c2)n1
InChIInChI=1S/C14H18N4/c1-11-5-4-6-13(17-11)16-10-12-7-8-15-14(9-12)18(2)3/h4-9H,10H2,1-3H3,(H,16,17)
InChIKeyMHSNARQMYGAYPU-UHFFFAOYSA-N
XLogP2.46
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.33
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[2-(dimethylamino)-4-pyridinyl]methyl]-6-methylpyridin-2-amine?
The IUPAC name of N-[[2-(dimethylamino)-4-pyridinyl]methyl]-6-methylpyridin-2-amine (CID 133313823) is N-[[2-(dimethylamino)-4-pyridinyl]methyl]-6-methylpyridin-2-amine.
What is the SMILES notation for N-[[2-(dimethylamino)-4-pyridinyl]methyl]-6-methylpyridin-2-amine?
The canonical SMILES for N-[[2-(dimethylamino)-4-pyridinyl]methyl]-6-methylpyridin-2-amine is Cc1cccc(NCc2ccnc(N(C)C)c2)n1.
What is the InChIKey of N-[[2-(dimethylamino)-4-pyridinyl]methyl]-6-methylpyridin-2-amine?
The InChIKey is MHSNARQMYGAYPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4/c1-11-5-4-6-13(17-11)16-10-12-7-8-15-14(9-12)18(2)3/h4-9H,10H2,1-3H3,(H,16,17).
What are the key properties of N-[[2-(dimethylamino)-4-pyridinyl]methyl]-6-methylpyridin-2-amine?
N-[[2-(dimethylamino)-4-pyridinyl]methyl]-6-methylpyridin-2-amine has a molecular weight of 242.33 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(dimethylamino)-4-pyridinyl]methyl]-6-methylpyridin-2-amine is sourced from PubChem (CID 133313823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).