N-[[4,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-5-yl]methyl]propan-1-amine

C15H26N4O — CID 79088552

IUPACN-[[4,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-5-yl]methyl]propan-1-amine
SMILESCCCNCc1c(C)nc(C2CN(C)CCO2)nc1C
InChIInChI=1S/C15H26N4O/c1-5-6-16-9-13-11(2)17-15(18-12(13)3)14-10-19(4)7-8-20-14/h14,16H,5-10H2,1-4H3
InChIKeyZXDAROBVFOBUCV-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.60
Rot. Bonds5

About N-[[4,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-5-yl]methyl]propan-1-amine

N-[[4,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-5-yl]methyl]propan-1-amine (PubChem CID 79088552) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[[4,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-5-yl]methyl]propan-1-amine.

Molecular Properties

Compound NameN-[[4,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-5-yl]methyl]propan-1-amine
PubChem CID79088552
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN-[[4,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-5-yl]methyl]propan-1-amine
SMILESCCCNCc1c(C)nc(C2CN(C)CCO2)nc1C
InChIInChI=1S/C15H26N4O/c1-5-6-16-9-13-11(2)17-15(18-12(13)3)14-10-19(4)7-8-20-14/h14,16H,5-10H2,1-4H3
InChIKeyZXDAROBVFOBUCV-UHFFFAOYSA-N
XLogP1.60
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-[4,6-dimethyl-2-(4-propylmorpholin-2-yl)pyrimidin-5-yl]-N-methylmethanamine
CID 79657347
6-ethyl-5-methyl-2-(4-methylmorpholin-2-yl)-N-propylpyrimidin-4-amine
CID 79089266
N-ethyl-5-fluoro-6-methyl-2-(4-methylmorpholin-2-yl)pyrimidin-4-amine
CID 79088256
5,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-4-amine
CID 79088525
N-[[4,6-dimethyl-2-(oxan-4-yl)pyrimidin-5-yl]methyl]propan-1-amine
CID 65334784
4,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidine-5-carboxylic acid
CID 79089338
5-iodo-2-(4-methylmorpholin-2-yl)-6-propan-2-yl-N-propylpyrimidin-4-amine
CID 79096567
5-bromo-2-(4-methylmorpholin-2-yl)-N,6-dipropylpyrimidin-4-amine
CID 79096555
N-methyl-1-[6-methyl-2-(4-methylmorpholin-2-yl)pyrimidin-4-yl]methanamine
CID 79089279
2-(4-chloro-6-methyl-5-propan-2-ylpyrimidin-2-yl)-4-methylmorpholine
CID 79077180
6-methyl-2-(4-methylmorpholin-2-yl)-5-propan-2-ylpyrimidin-4-amine
CID 79088985
4-methyl-6-(4-methylmorpholin-2-yl)-1,3,5-triazin-2-amine
CID 79085098

Frequently Asked Questions

What is the IUPAC name of N-[[4,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-5-yl]methyl]propan-1-amine?
The IUPAC name of N-[[4,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-5-yl]methyl]propan-1-amine (CID 79088552) is N-[[4,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-5-yl]methyl]propan-1-amine.
What is the SMILES notation for N-[[4,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-5-yl]methyl]propan-1-amine?
The canonical SMILES for N-[[4,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-5-yl]methyl]propan-1-amine is CCCNCc1c(C)nc(C2CN(C)CCO2)nc1C.
What is the InChIKey of N-[[4,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-5-yl]methyl]propan-1-amine?
The InChIKey is ZXDAROBVFOBUCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-5-6-16-9-13-11(2)17-15(18-12(13)3)14-10-19(4)7-8-20-14/h14,16H,5-10H2,1-4H3.
What are the key properties of N-[[4,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-5-yl]methyl]propan-1-amine?
N-[[4,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-5-yl]methyl]propan-1-amine has a molecular weight of 278.40 g/mol, XLogP of 1.60, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-5-yl]methyl]propan-1-amine is sourced from PubChem (CID 79088552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).