4-[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine

C15H24N6O — CID 133123239

IUPAC4-[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine
SMILESNc1nc(N2CCOCC2)cc(N2C[C@@H](N)[C@H](C3CC3)C2)n1
InChIInChI=1S/C15H24N6O/c16-12-9-21(8-11(12)10-1-2-10)14-7-13(18-15(17)19-14)20-3-5-22-6-4-20/h7,10-12H,1-6,8-9,16H2,(H2,17,18,19)/t11-,12+/m0/s1
InChIKeyKJTVBELVCNOLKQ-NWDGAFQWSA-N
MW304.40 g/mol
LogP0.07
Rot. Bonds3

About 4-[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine

4-[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine (PubChem CID 133123239) has the molecular formula C15H24N6O and a molecular weight of 304.40 g/mol. Its IUPAC name is 4-[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine.

Molecular Properties

Compound Name4-[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine
PubChem CID133123239
Molecular FormulaC15H24N6O
Molecular Weight304.40 g/mol
Exact Mass304.20
IUPAC Name4-[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine
SMILESNc1nc(N2CCOCC2)cc(N2C[C@@H](N)[C@H](C3CC3)C2)n1
InChIInChI=1S/C15H24N6O/c16-12-9-21(8-11(12)10-1-2-10)14-7-13(18-15(17)19-14)20-3-5-22-6-4-20/h7,10-12H,1-6,8-9,16H2,(H2,17,18,19)/t11-,12+/m0/s1
InChIKeyKJTVBELVCNOLKQ-NWDGAFQWSA-N
XLogP0.07
TPSA93.53 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.40
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

4-[(2S,6R)-4-azatricyclo[5.2.2.02,6]undecan-4-yl]-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 56868687
6-[(3R,4S)-3-amino-4-cyclopropylpyrrolidin-1-yl]-2-N,2-N-dimethylpyrimidine-2,4-diamine
CID 72934333
(3S,4S)-1-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-4-propylpyrrolidine-3-carboxylic acid
CID 72914892
2-(2,6-diaminopyrimidin-4-yl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-4-ol
CID 113399583
(3R,4S)-4-cyclopropyl-1-(6-methyl-2-piperidin-1-ylpyrimidin-4-yl)pyrrolidin-3-amine
CID 72865929
4-N-methyl-6-morpholin-4-ylpyrimidine-2,4-diamine
CID 80767642
4-methyl-6-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]pyrimidin-2-amine
CID 154838178
4-[3-(1H-imidazol-2-yl)piperidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine
CID 70730935
4-(3,3-dimethyl-4-phenylpyrrolidin-1-yl)-6-morpholin-4-ylpyrimidin-2-amine
CID 121496507
4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine
CID 50982860
4-N-(1-benzylpiperidin-4-yl)-6-morpholin-4-ylpyrimidine-2,4-diamine
CID 117085878
(3S,4R)-4-cyclopropyl-1-(7-methoxy-4-methylquinolin-2-yl)pyrrolidin-3-amine
CID 133130921

Frequently Asked Questions

What is the IUPAC name of 4-[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine?
The IUPAC name of 4-[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine (CID 133123239) is 4-[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine.
What is the SMILES notation for 4-[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine?
The canonical SMILES for 4-[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine is Nc1nc(N2CCOCC2)cc(N2C[C@@H](N)[C@H](C3CC3)C2)n1.
What is the InChIKey of 4-[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine?
The InChIKey is KJTVBELVCNOLKQ-NWDGAFQWSA-N. The full InChI is InChI=1S/C15H24N6O/c16-12-9-21(8-11(12)10-1-2-10)14-7-13(18-15(17)19-14)20-3-5-22-6-4-20/h7,10-12H,1-6,8-9,16H2,(H2,17,18,19)/t11-,12+/m0/s1.
What are the key properties of 4-[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine?
4-[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine has a molecular weight of 304.40 g/mol, XLogP of 0.07, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3S,4R)-3-amino-4-cyclopropylpyrrolidin-1-yl]-6-morpholin-4-ylpyrimidin-2-amine is sourced from PubChem (CID 133123239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).