N'-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine

C15H20N4 — CID 117212501

IUPACN'-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine
SMILESCc1ccccc1-c1nc(C)c(NCCN)c(C)n1
InChIInChI=1S/C15H20N4/c1-10-6-4-5-7-13(10)15-18-11(2)14(12(3)19-15)17-9-8-16/h4-7,17H,8-9,16H2,1-3H3
InChIKeyRCIBNSUOTSRMNS-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.44
Rot. Bonds4

About N'-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine

N'-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine (PubChem CID 117212501) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is N'-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine
PubChem CID117212501
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC NameN'-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine
SMILESCc1ccccc1-c1nc(C)c(NCCN)c(C)n1
InChIInChI=1S/C15H20N4/c1-10-6-4-5-7-13(10)15-18-11(2)14(12(3)19-15)17-9-8-16/h4-7,17H,8-9,16H2,1-3H3
InChIKeyRCIBNSUOTSRMNS-UHFFFAOYSA-N
XLogP2.44
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N'-[2-(2-methoxyphenyl)-4,6-dimethylpyrimidin-5-yl]ethane-1,2-diamine
CID 117212505
N'-[4-methyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine
CID 117212333
[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]methanamine;hydrochloride
CID 82021867
3-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]-N-methylpropan-1-amine
CID 62746134
[5,6-dimethyl-2-(2-methylphenyl)pyrimidin-4-yl]hydrazine
CID 62252584
5-bromo-6-methyl-2-(2-methylphenyl)pyrimidin-4-amine
CID 66306257
N-[2-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethyl]propan-1-amine
CID 62744407
5-bromo-N-ethyl-6-methyl-2-(2-methylphenyl)pyrimidin-4-amine
CID 66306280
N,5-diethyl-6-methyl-2-(2-methylphenyl)pyrimidin-4-amine
CID 62191964
6-(2-methylphenyl)-1,3,5-triazine-2,4-diamine
CID 2730671
2-[4,6-diethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethanamine
CID 79218553
N'-[2-(2-methylphenyl)-4-phenylpyrimidin-5-yl]propane-1,3-diamine
CID 117211758

Frequently Asked Questions

What is the IUPAC name of N'-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine?
The IUPAC name of N'-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine (CID 117212501) is N'-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine.
What is the SMILES notation for N'-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine?
The canonical SMILES for N'-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine is Cc1ccccc1-c1nc(C)c(NCCN)c(C)n1.
What is the InChIKey of N'-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine?
The InChIKey is RCIBNSUOTSRMNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-10-6-4-5-7-13(10)15-18-11(2)14(12(3)19-15)17-9-8-16/h4-7,17H,8-9,16H2,1-3H3.
What are the key properties of N'-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine?
N'-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine has a molecular weight of 256.35 g/mol, XLogP of 2.44, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine is sourced from PubChem (CID 117212501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).