N-ethyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine

C13H22N4O — CID 79663349

IUPACN-ethyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine
SMILESCCNc1ccnc(C2CN(C(C)C)CCO2)n1
InChIInChI=1S/C13H22N4O/c1-4-14-12-5-6-15-13(16-12)11-9-17(10(2)3)7-8-18-11/h5-6,10-11H,4,7-9H2,1-3H3,(H,14,15,16)
InChIKeyZMTRTUKKMLCBIU-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.69
Rot. Bonds4

About N-ethyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine

N-ethyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine (PubChem CID 79663349) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is N-ethyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine
PubChem CID79663349
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC NameN-ethyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine
SMILESCCNc1ccnc(C2CN(C(C)C)CCO2)n1
InChIInChI=1S/C13H22N4O/c1-4-14-12-5-6-15-13(16-12)11-9-17(10(2)3)7-8-18-11/h5-6,10-11H,4,7-9H2,1-3H3,(H,14,15,16)
InChIKeyZMTRTUKKMLCBIU-UHFFFAOYSA-N
XLogP1.69
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-6-(methoxymethyl)-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine
CID 79662651
2-methoxy-N-[[2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]methyl]ethanamine
CID 79663141
4-(4-propan-2-ylmorpholin-2-yl)-1,3,5-triazin-2-amine
CID 79663164
4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-amine
CID 114207025
2-(4-propan-2-ylmorpholin-2-yl)pyrimidine-5-carbaldehyde
CID 79665806
(1S)-1-[4-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-5-yl]ethanamine
CID 103431910
[6-cyclopropyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-yl]hydrazine
CID 79663146
4-propan-2-yl-2-pyridin-4-ylmorpholine
CID 176665996
4-ethyl-6-(4-propan-2-ylmorpholin-2-yl)-1,3,5-triazin-2-amine
CID 79662449
N-[[2-(4-ethylmorpholin-2-yl)pyrimidin-4-yl]methyl]-2-methylpropan-1-amine
CID 79669202
1-[3-(4-propan-2-ylmorpholin-2-yl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 79657430
2-[3-(4-propan-2-ylmorpholin-2-yl)-1,2,4-oxadiazol-5-yl]butan-2-amine
CID 79798084

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine?
The IUPAC name of N-ethyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine (CID 79663349) is N-ethyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine.
What is the SMILES notation for N-ethyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine?
The canonical SMILES for N-ethyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine is CCNc1ccnc(C2CN(C(C)C)CCO2)n1.
What is the InChIKey of N-ethyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine?
The InChIKey is ZMTRTUKKMLCBIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-4-14-12-5-6-15-13(16-12)11-9-17(10(2)3)7-8-18-11/h5-6,10-11H,4,7-9H2,1-3H3,(H,14,15,16).
What are the key properties of N-ethyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine?
N-ethyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine has a molecular weight of 250.35 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 79663349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).