4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine

C11H13N5 — CID 78929798

IUPAC4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine
SMILESNc1cc(NCCc2ccccn2)ncn1
InChIInChI=1S/C11H13N5/c12-10-7-11(16-8-15-10)14-6-4-9-3-1-2-5-13-9/h1-3,5,7-8H,4,6H2,(H3,12,14,15,16)
InChIKeyNEMVUPAKPBGRLY-UHFFFAOYSA-N
MW215.26 g/mol
LogP1.11
Rot. Bonds4

About 4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine

4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine (PubChem CID 78929798) has the molecular formula C11H13N5 and a molecular weight of 215.26 g/mol. Its IUPAC name is 4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine
PubChem CID78929798
Molecular FormulaC11H13N5
Molecular Weight215.26 g/mol
Exact Mass215.12
IUPAC Name4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine
SMILESNc1cc(NCCc2ccccn2)ncn1
InChIInChI=1S/C11H13N5/c12-10-7-11(16-8-15-10)14-6-4-9-3-1-2-5-13-9/h1-3,5,7-8H,4,6H2,(H3,12,14,15,16)
InChIKeyNEMVUPAKPBGRLY-UHFFFAOYSA-N
XLogP1.11
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.26
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-propan-2-yl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine
CID 61240928
4-N-propan-2-yl-6-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine
CID 115265848
4-N-(2-pyridin-4-ylethyl)pyrimidine-4,6-diamine
CID 80790889
4-chloro-N-(2-pyridin-2-ylethyl)pyridin-2-amine
CID 19432992
6-N-(2-pyridin-2-ylethyl)-4-N-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine
CID 117091899
6-N-(2-pyridin-2-ylethyl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717234
2-[methyl-[6-(2-pyridin-2-ylethylamino)pyrimidin-4-yl]amino]acetonitrile
CID 115266242
2-(2-pyridin-2-ylethylamino)pyridine-4-carbothioamide
CID 24696486
N-(2-pyridin-2-ylethyl)pyrazin-2-amine
CID 28544593
2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine
CID 115978124
6-hydrazinyl-N-(2-pyridin-2-ylethyl)pyridin-2-amine
CID 80932444
4-chloro-2-N-(2-pyridin-2-ylethyl)benzene-1,2-diamine
CID 115468470

Frequently Asked Questions

What is the IUPAC name of 4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine?
The IUPAC name of 4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine (CID 78929798) is 4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine?
The canonical SMILES for 4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine is Nc1cc(NCCc2ccccn2)ncn1.
What is the InChIKey of 4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine?
The InChIKey is NEMVUPAKPBGRLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5/c12-10-7-11(16-8-15-10)14-6-4-9-3-1-2-5-13-9/h1-3,5,7-8H,4,6H2,(H3,12,14,15,16).
What are the key properties of 4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine?
4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine has a molecular weight of 215.26 g/mol, XLogP of 1.11, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine is sourced from PubChem (CID 78929798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).