1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine

C12H20N4O — CID 62699740

IUPAC1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine
SMILESCC(CN1CCOCC1)NCc1ncccn1
InChIInChI=1S/C12H20N4O/c1-11(10-16-5-7-17-8-6-16)15-9-12-13-3-2-4-14-12/h2-4,11,15H,5-10H2,1H3
InChIKeyOINUQMDZRRJSHX-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.29
Rot. Bonds5

About 1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine

1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine (PubChem CID 62699740) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine.

Molecular Properties

Compound Name1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine
PubChem CID62699740
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine
SMILESCC(CN1CCOCC1)NCc1ncccn1
InChIInChI=1S/C12H20N4O/c1-11(10-16-5-7-17-8-6-16)15-9-12-13-3-2-4-14-12/h2-4,11,15H,5-10H2,1H3
InChIKeyOINUQMDZRRJSHX-UHFFFAOYSA-N
XLogP0.29
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 115761765
1-morpholin-4-yl-N-[(1-propylimidazol-2-yl)methyl]propan-2-amine
CID 62956125
N-[(5-methyl-1H-pyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 112688776
1-morpholin-4-yl-N-[(1-propan-2-ylpyrazol-3-yl)methyl]propan-2-amine
CID 64771808
N-[(1-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 78921223
N-(3H-benzimidazol-5-ylmethyl)-1-morpholin-4-ylpropan-2-amine
CID 115607201
N-[(5-ethylfuran-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 62345255
1-morpholin-4-yl-N-[(3,4,5-trifluorophenyl)methyl]propan-2-amine
CID 63051875
N-[[2-(difluoromethoxy)phenyl]methyl]-1-morpholin-4-ylpropan-2-amine
CID 43675802
N-[(2,4-dichlorophenyl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 43675759
3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 62733426
3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 75373063

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine?
The IUPAC name of 1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine (CID 62699740) is 1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine.
What is the SMILES notation for 1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine?
The canonical SMILES for 1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine is CC(CN1CCOCC1)NCc1ncccn1.
What is the InChIKey of 1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine?
The InChIKey is OINUQMDZRRJSHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-11(10-16-5-7-17-8-6-16)15-9-12-13-3-2-4-14-12/h2-4,11,15H,5-10H2,1H3.
What are the key properties of 1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine?
1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine has a molecular weight of 236.32 g/mol, XLogP of 0.29, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine is sourced from PubChem (CID 62699740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).