N,6-dimethyl-N-(3-methylphenyl)pyrimidin-4-amine;propane

C16H23N3 — CID 143158754

IUPACN,6-dimethyl-N-(3-methylphenyl)pyrimidin-4-amine;propane
SMILESCCC.Cc1cccc(N(C)c2cc(C)ncn2)c1
InChIInChI=1S/C13H15N3.C3H8/c1-10-5-4-6-12(7-10)16(3)13-8-11(2)14-9-15-13;1-3-2/h4-9H,1-3H3;3H2,1-2H3
InChIKeySWQCIZAOXCSQAH-UHFFFAOYSA-N
MW257.38 g/mol
LogP4.28
Rot. Bonds2

About N,6-dimethyl-N-(3-methylphenyl)pyrimidin-4-amine;propane

N,6-dimethyl-N-(3-methylphenyl)pyrimidin-4-amine;propane (PubChem CID 143158754) has the molecular formula C16H23N3 and a molecular weight of 257.38 g/mol. Its IUPAC name is N,6-dimethyl-N-(3-methylphenyl)pyrimidin-4-amine;propane.

Molecular Properties

Compound NameN,6-dimethyl-N-(3-methylphenyl)pyrimidin-4-amine;propane
PubChem CID143158754
Molecular FormulaC16H23N3
Molecular Weight257.38 g/mol
Exact Mass257.19
IUPAC NameN,6-dimethyl-N-(3-methylphenyl)pyrimidin-4-amine;propane
SMILESCCC.Cc1cccc(N(C)c2cc(C)ncn2)c1
InChIInChI=1S/C13H15N3.C3H8/c1-10-5-4-6-12(7-10)16(3)13-8-11(2)14-9-15-13;1-3-2/h4-9H,1-3H3;3H2,1-2H3
InChIKeySWQCIZAOXCSQAH-UHFFFAOYSA-N
XLogP4.28
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,6-dimethyl-N-(3-methylphenyl)pyrimidin-4-amine
CID 143158755
3-[methyl-(6-methylpyrimidin-4-yl)amino]benzenethiol;propane
CID 143158787
2-N-methyl-2-N-(3-methylphenyl)pyridine-2,4-diamine
CID 62002618
4-N,4-N-diethyl-6-N-methyl-6-N-phenylpyrimidine-4,6-diamine
CID 112863464
6-chloro-2-ethyl-N-methyl-N-(3-methylphenyl)pyrimidin-4-amine
CID 80935558
2-N-methyl-2-N-(3-methylphenyl)-1,3,5-triazine-2,4-diamine
CID 150772863
4-N-[3-(dimethylamino)phenyl]-4-N-methylpyrimidine-4,6-diamine
CID 174682956
N-methyl-N-(3-methylphenyl)-5-(propylaminomethyl)pyridin-2-amine
CID 62293001
methyl 2-(N,3-dimethylanilino)pyridine-4-carboxylate
CID 114075012
4-N-methyl-4-N-(3-methylphenyl)quinazoline-4,7-diamine
CID 65336690
N-methyl-N-(3-methylphenyl)pyridin-4-amine
CID 89072633
3-[(6-ethylpyrimidin-4-yl)-methylamino]benzenecarboximidamide
CID 62970344

Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-N-(3-methylphenyl)pyrimidin-4-amine;propane?
The IUPAC name of N,6-dimethyl-N-(3-methylphenyl)pyrimidin-4-amine;propane (CID 143158754) is N,6-dimethyl-N-(3-methylphenyl)pyrimidin-4-amine;propane.
What is the SMILES notation for N,6-dimethyl-N-(3-methylphenyl)pyrimidin-4-amine;propane?
The canonical SMILES for N,6-dimethyl-N-(3-methylphenyl)pyrimidin-4-amine;propane is CCC.Cc1cccc(N(C)c2cc(C)ncn2)c1.
What is the InChIKey of N,6-dimethyl-N-(3-methylphenyl)pyrimidin-4-amine;propane?
The InChIKey is SWQCIZAOXCSQAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3.C3H8/c1-10-5-4-6-12(7-10)16(3)13-8-11(2)14-9-15-13;1-3-2/h4-9H,1-3H3;3H2,1-2H3.
What are the key properties of N,6-dimethyl-N-(3-methylphenyl)pyrimidin-4-amine;propane?
N,6-dimethyl-N-(3-methylphenyl)pyrimidin-4-amine;propane has a molecular weight of 257.38 g/mol, XLogP of 4.28, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-N-(3-methylphenyl)pyrimidin-4-amine;propane is sourced from PubChem (CID 143158754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).