6-chloro-5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-2-propan-2-ylpyrimidin-4-amine

C15H25ClN4O — CID 80979023

IUPAC6-chloro-5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-2-propan-2-ylpyrimidin-4-amine
SMILESCc1c(Cl)nc(C(C)C)nc1NC(C)CN1CCOCC1
InChIInChI=1S/C15H25ClN4O/c1-10(2)14-18-13(16)12(4)15(19-14)17-11(3)9-20-5-7-21-8-6-20/h10-11H,5-9H2,1-4H3,(H,17,18,19)
InChIKeyAZXYWFBSFLHOLB-UHFFFAOYSA-N
MW312.85 g/mol
LogP2.69
Rot. Bonds5

About 6-chloro-5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-2-propan-2-ylpyrimidin-4-amine

6-chloro-5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-2-propan-2-ylpyrimidin-4-amine (PubChem CID 80979023) has the molecular formula C15H25ClN4O and a molecular weight of 312.85 g/mol. Its IUPAC name is 6-chloro-5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-chloro-5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-2-propan-2-ylpyrimidin-4-amine
PubChem CID80979023
Molecular FormulaC15H25ClN4O
Molecular Weight312.85 g/mol
Exact Mass312.17
IUPAC Name6-chloro-5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-2-propan-2-ylpyrimidin-4-amine
SMILESCc1c(Cl)nc(C(C)C)nc1NC(C)CN1CCOCC1
InChIInChI=1S/C15H25ClN4O/c1-10(2)14-18-13(16)12(4)15(19-14)17-11(3)9-20-5-7-21-8-6-20/h10-11H,5-9H2,1-4H3,(H,17,18,19)
InChIKeyAZXYWFBSFLHOLB-UHFFFAOYSA-N
XLogP2.69
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.85
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-chloro-5-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)-2-propan-2-ylpyrimidin-4-amine
CID 80971664
2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine
CID 79633115
4-[(6-chloro-5-methyl-2-propan-2-ylpyrimidin-4-yl)amino]pentan-1-ol
CID 80978575
6-chloro-5-methyl-N-(3-methylbutan-2-yl)-2-propan-2-ylpyrimidin-4-amine
CID 80973311
6-chloro-5-methyl-N-(4-methyloxan-4-yl)-2-propan-2-ylpyrimidin-4-amine
CID 113491272
6-chloro-5-methyl-N-(3-methylpentan-2-yl)-2-propan-2-ylpyrimidin-4-amine
CID 80971108
6-chloro-N-(1-morpholin-4-ylpropan-2-yl)pyrazin-2-amine
CID 47370622
6-chloro-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 63586349
3-bromo-4-methyl-2-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2,5-diamine
CID 104506572
4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile
CID 60965079
3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 75373063
1-(1-morpholin-4-ylpropan-2-ylamino)isoquinolin-7-ol
CID 106538109

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-chloro-5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-2-propan-2-ylpyrimidin-4-amine (CID 80979023) is 6-chloro-5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-chloro-5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-chloro-5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-2-propan-2-ylpyrimidin-4-amine is Cc1c(Cl)nc(C(C)C)nc1NC(C)CN1CCOCC1.
What is the InChIKey of 6-chloro-5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is AZXYWFBSFLHOLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25ClN4O/c1-10(2)14-18-13(16)12(4)15(19-14)17-11(3)9-20-5-7-21-8-6-20/h10-11H,5-9H2,1-4H3,(H,17,18,19).
What are the key properties of 6-chloro-5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-2-propan-2-ylpyrimidin-4-amine?
6-chloro-5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 312.85 g/mol, XLogP of 2.69, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 80979023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).