4-[(dimethylamino)methyl]-3H-pyridin-4-amine

C8H15N3 — CID 69448277

IUPAC4-[(dimethylamino)methyl]-3H-pyridin-4-amine
SMILESCN(C)CC1(N)C=CN=CC1
InChIInChI=1S/C8H15N3/c1-11(2)7-8(9)3-5-10-6-4-8/h3,5-6H,4,7,9H2,1-2H3
InChIKeyVDNJPYLHRJBMGS-UHFFFAOYSA-N
MW153.23 g/mol
LogP0.23
Rot. Bonds2

About 4-[(dimethylamino)methyl]-3H-pyridin-4-amine

4-[(dimethylamino)methyl]-3H-pyridin-4-amine (PubChem CID 69448277) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is 4-[(dimethylamino)methyl]-3H-pyridin-4-amine.

Molecular Properties

Compound Name4-[(dimethylamino)methyl]-3H-pyridin-4-amine
PubChem CID69448277
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name4-[(dimethylamino)methyl]-3H-pyridin-4-amine
SMILESCN(C)CC1(N)C=CN=CC1
InChIInChI=1S/C8H15N3/c1-11(2)7-8(9)3-5-10-6-4-8/h3,5-6H,4,7,9H2,1-2H3
InChIKeyVDNJPYLHRJBMGS-UHFFFAOYSA-N
XLogP0.23
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(dimethylamino)methyl]-3H-pyridin-4-amine?
The IUPAC name of 4-[(dimethylamino)methyl]-3H-pyridin-4-amine (CID 69448277) is 4-[(dimethylamino)methyl]-3H-pyridin-4-amine.
What is the SMILES notation for 4-[(dimethylamino)methyl]-3H-pyridin-4-amine?
The canonical SMILES for 4-[(dimethylamino)methyl]-3H-pyridin-4-amine is CN(C)CC1(N)C=CN=CC1.
What is the InChIKey of 4-[(dimethylamino)methyl]-3H-pyridin-4-amine?
The InChIKey is VDNJPYLHRJBMGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-11(2)7-8(9)3-5-10-6-4-8/h3,5-6H,4,7,9H2,1-2H3.
What are the key properties of 4-[(dimethylamino)methyl]-3H-pyridin-4-amine?
4-[(dimethylamino)methyl]-3H-pyridin-4-amine has a molecular weight of 153.23 g/mol, XLogP of 0.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(dimethylamino)methyl]-3H-pyridin-4-amine is sourced from PubChem (CID 69448277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).