N-methyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylpyrimidin-2-amine

C13H22N4O — CID 116978150

IUPACN-methyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylpyrimidin-2-amine
SMILESCC(C)c1cnc(N(C)CC2CNCCO2)nc1
InChIInChI=1S/C13H22N4O/c1-10(2)11-6-15-13(16-7-11)17(3)9-12-8-14-4-5-18-12/h6-7,10,12,14H,4-5,8-9H2,1-3H3
InChIKeyXZMIBQBTJUZDQR-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.02
Rot. Bonds4

About N-methyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylpyrimidin-2-amine

N-methyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylpyrimidin-2-amine (PubChem CID 116978150) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is N-methyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylpyrimidin-2-amine.

Molecular Properties

Compound NameN-methyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylpyrimidin-2-amine
PubChem CID116978150
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC NameN-methyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylpyrimidin-2-amine
SMILESCC(C)c1cnc(N(C)CC2CNCCO2)nc1
InChIInChI=1S/C13H22N4O/c1-10(2)11-6-15-13(16-7-11)17(3)9-12-8-14-4-5-18-12/h6-7,10,12,14H,4-5,8-9H2,1-3H3
InChIKeyXZMIBQBTJUZDQR-UHFFFAOYSA-N
XLogP1.02
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 ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-N-(morpholin-2-ylmethyl)-5-propylpyrimidin-2-amine
CID 116978147
N,2-dimethyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylaniline
CID 115237568
N-methyl-N-(morpholin-2-ylmethyl)quinazolin-2-amine
CID 114789529
5-[(2,6-dichlorophenyl)methoxy]-N-methyl-N-(morpholin-2-ylmethyl)pyrimidin-2-amine
CID 170608853
N-methyl-5-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrimidin-2-amine
CID 116977565
N,N-dimethyl-6-[methyl(morpholin-2-ylmethyl)amino]pyridine-3-sulfonamide
CID 103341176
N,6-dimethyl-N-(morpholin-2-ylmethyl)-1,3-benzodioxol-5-amine
CID 115237589
3-[methyl(morpholin-2-ylmethyl)amino]-1H-pyrazin-2-one
CID 114571026
1-methyl-3-[methyl-[[(2S)-morpholin-2-yl]methyl]amino]pyrazin-2-one
CID 98013250
N-methyl-4-methylsulfanyl-N-(morpholin-2-ylmethyl)aniline
CID 115237571
4-methoxy-N,3,5-trimethyl-N-(morpholin-2-ylmethyl)aniline
CID 115237588
N,1-dimethyl-N-(morpholin-2-ylmethyl)benzimidazol-5-amine
CID 115237579

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylpyrimidin-2-amine?
The IUPAC name of N-methyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylpyrimidin-2-amine (CID 116978150) is N-methyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylpyrimidin-2-amine.
What is the SMILES notation for N-methyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylpyrimidin-2-amine?
The canonical SMILES for N-methyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylpyrimidin-2-amine is CC(C)c1cnc(N(C)CC2CNCCO2)nc1.
What is the InChIKey of N-methyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylpyrimidin-2-amine?
The InChIKey is XZMIBQBTJUZDQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-10(2)11-6-15-13(16-7-11)17(3)9-12-8-14-4-5-18-12/h6-7,10,12,14H,4-5,8-9H2,1-3H3.
What are the key properties of N-methyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylpyrimidin-2-amine?
N-methyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylpyrimidin-2-amine has a molecular weight of 250.35 g/mol, XLogP of 1.02, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylpyrimidin-2-amine is sourced from PubChem (CID 116978150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).