4-methyl-N,N-dipropyl-5-(propylaminomethyl)pyrimidin-2-amine

C15H28N4 — CID 83186192

IUPAC4-methyl-N,N-dipropyl-5-(propylaminomethyl)pyrimidin-2-amine
SMILESCCCNCc1cnc(N(CCC)CCC)nc1C
InChIInChI=1S/C15H28N4/c1-5-8-16-11-14-12-17-15(18-13(14)4)19(9-6-2)10-7-3/h12,16H,5-11H2,1-4H3
InChIKeyMXUGEHLBJUTMAJ-UHFFFAOYSA-N
MW264.42 g/mol
LogP2.91
Rot. Bonds9

About 4-methyl-N,N-dipropyl-5-(propylaminomethyl)pyrimidin-2-amine

4-methyl-N,N-dipropyl-5-(propylaminomethyl)pyrimidin-2-amine (PubChem CID 83186192) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 4-methyl-N,N-dipropyl-5-(propylaminomethyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-methyl-N,N-dipropyl-5-(propylaminomethyl)pyrimidin-2-amine
PubChem CID83186192
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name4-methyl-N,N-dipropyl-5-(propylaminomethyl)pyrimidin-2-amine
SMILESCCCNCc1cnc(N(CCC)CCC)nc1C
InChIInChI=1S/C15H28N4/c1-5-8-16-11-14-12-17-15(18-13(14)4)19(9-6-2)10-7-3/h12,16H,5-11H2,1-4H3
InChIKeyMXUGEHLBJUTMAJ-UHFFFAOYSA-N
XLogP2.91
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-(ethylaminomethyl)-4-methyl-N,N-dipropylpyrimidin-2-amine
CID 83186275
N-(cyclopropylmethyl)-4-methyl-N-propyl-5-(propylaminomethyl)pyrimidin-2-amine
CID 83186228
N,N,N'-trimethyl-N'-[4-methyl-5-(propylaminomethyl)pyrimidin-2-yl]propane-1,3-diamine
CID 83185920
N,4-dimethyl-N-(3-methylbutyl)-5-(propylaminomethyl)pyrimidin-2-amine
CID 83185277
N,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine
CID 83186097
N-ethyl-4-methyl-N-phenyl-5-(propylaminomethyl)pyrimidin-2-amine
CID 83180589
N,N-dibutyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine
CID 83185864
N,4-dimethyl-N-(2-methylbutyl)-5-(propylaminomethyl)pyrimidin-2-amine
CID 83185424
N,4-dimethyl-N-(1-methylsulfanylpropan-2-yl)-5-(propylaminomethyl)pyrimidin-2-amine
CID 112665398
N-cyclopropyl-N-(2-methoxyethyl)-4-methyl-5-(propylaminomethyl)pyrimidin-2-amine
CID 83185808
4-methyl-N-propan-2-yl-N-prop-2-enyl-5-(propylaminomethyl)pyrimidin-2-amine
CID 83188945
N'-ethyl-N'-[5-(ethylaminomethyl)-4-methylpyrimidin-2-yl]-N,N-dimethylpropane-1,3-diamine
CID 102997398

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N,N-dipropyl-5-(propylaminomethyl)pyrimidin-2-amine?
The IUPAC name of 4-methyl-N,N-dipropyl-5-(propylaminomethyl)pyrimidin-2-amine (CID 83186192) is 4-methyl-N,N-dipropyl-5-(propylaminomethyl)pyrimidin-2-amine.
What is the SMILES notation for 4-methyl-N,N-dipropyl-5-(propylaminomethyl)pyrimidin-2-amine?
The canonical SMILES for 4-methyl-N,N-dipropyl-5-(propylaminomethyl)pyrimidin-2-amine is CCCNCc1cnc(N(CCC)CCC)nc1C.
What is the InChIKey of 4-methyl-N,N-dipropyl-5-(propylaminomethyl)pyrimidin-2-amine?
The InChIKey is MXUGEHLBJUTMAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-5-8-16-11-14-12-17-15(18-13(14)4)19(9-6-2)10-7-3/h12,16H,5-11H2,1-4H3.
What are the key properties of 4-methyl-N,N-dipropyl-5-(propylaminomethyl)pyrimidin-2-amine?
4-methyl-N,N-dipropyl-5-(propylaminomethyl)pyrimidin-2-amine has a molecular weight of 264.42 g/mol, XLogP of 2.91, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N,N-dipropyl-5-(propylaminomethyl)pyrimidin-2-amine is sourced from PubChem (CID 83186192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).