6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine

C13H16N4 — CID 55057435

IUPAC6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine
SMILESCCc1cc(NCc2cccc(C)n2)ncn1
InChIInChI=1S/C13H16N4/c1-3-11-7-13(16-9-15-11)14-8-12-6-4-5-10(2)17-12/h4-7,9H,3,8H2,1-2H3,(H,14,15,16)
InChIKeyDOWZJDPPPOUHJC-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.35
Rot. Bonds4

About 6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine

6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine (PubChem CID 55057435) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is 6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine
PubChem CID55057435
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC Name6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine
SMILESCCc1cc(NCc2cccc(C)n2)ncn1
InChIInChI=1S/C13H16N4/c1-3-11-7-13(16-9-15-11)14-8-12-6-4-5-10(2)17-12/h4-7,9H,3,8H2,1-2H3,(H,14,15,16)
InChIKeyDOWZJDPPPOUHJC-UHFFFAOYSA-N
XLogP2.35
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-[(6-methyl-2-pyridinyl)methyl]-6-N-propylpyrimidine-4,6-diamine
CID 80821682
6-ethyl-N-(quinolin-8-ylmethyl)pyrimidin-4-amine
CID 78958804
2-[(6-methyl-2-pyridinyl)methylamino]pyridine-4-carbonitrile
CID 62307193
2-methyl-4-N-[(6-methyl-2-pyridinyl)methyl]-6-N-propylpyrimidine-4,6-diamine
CID 80822100
3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline
CID 79268214
2-chloro-6-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine
CID 62482411
5-methyl-4-N-[(6-methyl-2-pyridinyl)methyl]-6-N-propylpyrimidine-4,6-diamine
CID 80822689
2-ethyl-4-[(6-methyl-2-pyridinyl)methylamino]-1H-pyrimidin-6-one
CID 136975306
6-bromo-N-[(6-methyl-2-pyridinyl)methyl]pyridin-2-amine
CID 63961124
5-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyridazin-3-amine
CID 106549703
3,5-dimethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline
CID 79267863
2,4-dimethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline
CID 79267404

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine?
The IUPAC name of 6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine (CID 55057435) is 6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine?
The canonical SMILES for 6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine is CCc1cc(NCc2cccc(C)n2)ncn1.
What is the InChIKey of 6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine?
The InChIKey is DOWZJDPPPOUHJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-3-11-7-13(16-9-15-11)14-8-12-6-4-5-10(2)17-12/h4-7,9H,3,8H2,1-2H3,(H,14,15,16).
What are the key properties of 6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine?
6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine has a molecular weight of 228.30 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 55057435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).