2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine

C11H16Cl2N4O — CID 79633115

IUPAC2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine
SMILESCC(CN1CCOCC1)Nc1nc(Cl)ncc1Cl
InChIInChI=1S/C11H16Cl2N4O/c1-8(7-17-2-4-18-5-3-17)15-10-9(12)6-14-11(13)16-10/h6,8H,2-5,7H2,1H3,(H,14,15,16)
InChIKeyOLCQDIDMOVTMKT-UHFFFAOYSA-N
MW291.18 g/mol
LogP1.92
Rot. Bonds4

About 2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine

2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine (PubChem CID 79633115) has the molecular formula C11H16Cl2N4O and a molecular weight of 291.18 g/mol. Its IUPAC name is 2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine
PubChem CID79633115
Molecular FormulaC11H16Cl2N4O
Molecular Weight291.18 g/mol
Exact Mass290.07
IUPAC Name2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine
SMILESCC(CN1CCOCC1)Nc1nc(Cl)ncc1Cl
InChIInChI=1S/C11H16Cl2N4O/c1-8(7-17-2-4-18-5-3-17)15-10-9(12)6-14-11(13)16-10/h6,8H,2-5,7H2,1H3,(H,14,15,16)
InChIKeyOLCQDIDMOVTMKT-UHFFFAOYSA-N
XLogP1.92
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.18
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-chloro-N-(1-morpholin-4-ylpropan-2-yl)pyrazin-2-amine
CID 47370622
2,5-dichloro-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine
CID 79633494
5-bromo-2-hydrazinyl-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine
CID 80897348
6-chloro-5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-2-propan-2-ylpyrimidin-4-amine
CID 80979023
6-chloro-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 63586349
3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 75373063
2-chloro-N-(1-morpholin-4-ylpropan-2-yl)pyridin-4-amine
CID 103721807
3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 62733426
3-bromo-4-methyl-2-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2,5-diamine
CID 104506572
1-(1-morpholin-4-ylpropan-2-ylamino)isoquinolin-7-ol
CID 106538109
5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine
CID 80802012
6-chloro-2-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2,4-diamine
CID 104918892

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine?
The IUPAC name of 2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine (CID 79633115) is 2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine?
The canonical SMILES for 2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine is CC(CN1CCOCC1)Nc1nc(Cl)ncc1Cl.
What is the InChIKey of 2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine?
The InChIKey is OLCQDIDMOVTMKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16Cl2N4O/c1-8(7-17-2-4-18-5-3-17)15-10-9(12)6-14-11(13)16-10/h6,8H,2-5,7H2,1H3,(H,14,15,16).
What are the key properties of 2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine?
2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine has a molecular weight of 291.18 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 79633115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).