N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine

C11H18N4O — CID 94220826

IUPACN-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine
SMILESC[C@@H](CN1CCOCC1)Nc1ccncn1
InChIInChI=1S/C11H18N4O/c1-10(8-15-4-6-16-7-5-15)14-11-2-3-12-9-13-11/h2-3,9-10H,4-8H2,1H3,(H,12,13,14)/t10-/m0/s1
InChIKeyHLMJQEYCZWIUQD-JTQLQIEISA-N
MW222.29 g/mol
LogP0.61
Rot. Bonds4

About N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine

N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine (PubChem CID 94220826) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine.

Molecular Properties

Compound NameN-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine
PubChem CID94220826
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC NameN-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine
SMILESC[C@@H](CN1CCOCC1)Nc1ccncn1
InChIInChI=1S/C11H18N4O/c1-10(8-15-4-6-16-7-5-15)14-11-2-3-12-9-13-11/h2-3,9-10H,4-8H2,1H3,(H,12,13,14)/t10-/m0/s1
InChIKeyHLMJQEYCZWIUQD-JTQLQIEISA-N
XLogP0.61
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine?
The IUPAC name of N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine (CID 94220826) is N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine.
What is the SMILES notation for N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine?
The canonical SMILES for N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine is C[C@@H](CN1CCOCC1)Nc1ccncn1.
What is the InChIKey of N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine?
The InChIKey is HLMJQEYCZWIUQD-JTQLQIEISA-N. The full InChI is InChI=1S/C11H18N4O/c1-10(8-15-4-6-16-7-5-15)14-11-2-3-12-9-13-11/h2-3,9-10H,4-8H2,1H3,(H,12,13,14)/t10-/m0/s1.
What are the key properties of N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine?
N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine has a molecular weight of 222.29 g/mol, XLogP of 0.61, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine is sourced from PubChem (CID 94220826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).