2-[4-[(dimethylamino)methyl]phenyl]pyridin-4-amine

C14H17N3 — CID 50983039

IUPAC2-[4-[(dimethylamino)methyl]phenyl]pyridin-4-amine
SMILESCN(C)Cc1ccc(-c2cc(N)ccn2)cc1
InChIInChI=1S/C14H17N3/c1-17(2)10-11-3-5-12(6-4-11)14-9-13(15)7-8-16-14/h3-9H,10H2,1-2H3,(H2,15,16)
InChIKeyAZTJXCGCSKQHIE-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.39
Rot. Bonds3

About 2-[4-[(dimethylamino)methyl]phenyl]pyridin-4-amine

2-[4-[(dimethylamino)methyl]phenyl]pyridin-4-amine (PubChem CID 50983039) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-[4-[(dimethylamino)methyl]phenyl]pyridin-4-amine.

Molecular Properties

Compound Name2-[4-[(dimethylamino)methyl]phenyl]pyridin-4-amine
PubChem CID50983039
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name2-[4-[(dimethylamino)methyl]phenyl]pyridin-4-amine
SMILESCN(C)Cc1ccc(-c2cc(N)ccn2)cc1
InChIInChI=1S/C14H17N3/c1-17(2)10-11-3-5-12(6-4-11)14-9-13(15)7-8-16-14/h3-9H,10H2,1-2H3,(H2,15,16)
InChIKeyAZTJXCGCSKQHIE-UHFFFAOYSA-N
XLogP2.39
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[(dimethylamino)methyl]phenyl]pyridin-4-amine?
The IUPAC name of 2-[4-[(dimethylamino)methyl]phenyl]pyridin-4-amine (CID 50983039) is 2-[4-[(dimethylamino)methyl]phenyl]pyridin-4-amine.
What is the SMILES notation for 2-[4-[(dimethylamino)methyl]phenyl]pyridin-4-amine?
The canonical SMILES for 2-[4-[(dimethylamino)methyl]phenyl]pyridin-4-amine is CN(C)Cc1ccc(-c2cc(N)ccn2)cc1.
What is the InChIKey of 2-[4-[(dimethylamino)methyl]phenyl]pyridin-4-amine?
The InChIKey is AZTJXCGCSKQHIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-17(2)10-11-3-5-12(6-4-11)14-9-13(15)7-8-16-14/h3-9H,10H2,1-2H3,(H2,15,16).
What are the key properties of 2-[4-[(dimethylamino)methyl]phenyl]pyridin-4-amine?
2-[4-[(dimethylamino)methyl]phenyl]pyridin-4-amine has a molecular weight of 227.31 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(dimethylamino)methyl]phenyl]pyridin-4-amine is sourced from PubChem (CID 50983039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).