5-amino-4-(cyclopentylamino)-6-morpholin-4-ylpyrimidine-2-carbonitrile

C14H20N6O — CID 44565778

IUPAC5-amino-4-(cyclopentylamino)-6-morpholin-4-ylpyrimidine-2-carbonitrile
SMILESN#Cc1nc(NC2CCCC2)c(N)c(N2CCOCC2)n1
InChIInChI=1S/C14H20N6O/c15-9-11-18-13(17-10-3-1-2-4-10)12(16)14(19-11)20-5-7-21-8-6-20/h10H,1-8,16H2,(H,17,18,19)
InChIKeyWFZYTAPCBPHQFC-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.12
Rot. Bonds3

About 5-amino-4-(cyclopentylamino)-6-morpholin-4-ylpyrimidine-2-carbonitrile

5-amino-4-(cyclopentylamino)-6-morpholin-4-ylpyrimidine-2-carbonitrile (PubChem CID 44565778) has the molecular formula C14H20N6O and a molecular weight of 288.35 g/mol. Its IUPAC name is 5-amino-4-(cyclopentylamino)-6-morpholin-4-ylpyrimidine-2-carbonitrile.

Molecular Properties

Compound Name5-amino-4-(cyclopentylamino)-6-morpholin-4-ylpyrimidine-2-carbonitrile
PubChem CID44565778
Molecular FormulaC14H20N6O
Molecular Weight288.35 g/mol
Exact Mass288.17
IUPAC Name5-amino-4-(cyclopentylamino)-6-morpholin-4-ylpyrimidine-2-carbonitrile
SMILESN#Cc1nc(NC2CCCC2)c(N)c(N2CCOCC2)n1
InChIInChI=1S/C14H20N6O/c15-9-11-18-13(17-10-3-1-2-4-10)12(16)14(19-11)20-5-7-21-8-6-20/h10H,1-8,16H2,(H,17,18,19)
InChIKeyWFZYTAPCBPHQFC-UHFFFAOYSA-N
XLogP1.12
TPSA100.09 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

5-Amino-4-(isobutylamino)-6-morpholinopyrimidine-2-carbonitrile
CID 25256832
5-Amino-4-(isopropylamino)-6-morpholinopyrimidine-2-carbonitrile
CID 44565777
5-Amino-4-(cyclohexylamino)-6-morpholinopyrimidine-2-carbonitrile
CID 44565779
5-Amino-4-morpholino-6-(neopentylamino)pyrimidine-2-carbonitrile
CID 44565796
5-Amino-4-(sec-butylamino)-6-morpholinopyrimidine-2-carbonitrile
CID 44565797
5-Amino-4-(bicyclo[2.2.1]heptan-2-ylamino)-6-morpholinopyrimidine-2-carbonitrile
CID 44565798
5-Amino-4-morpholino-6-(tetrahydrofuran-3-ylamino)pyrimidine-2-carbonitrile
CID 44565799
5-Amino-4-morpholino-6-(pyrrolidin-1-yl)pyrimidine-2-carbonitrile
CID 44565800
5-Amino-4-morpholino-6-(piperidin-1-yl)pyrimidine-2-carbonitrile
CID 44565818
5-Amino-4-(isobutylamino)-6-(2-methoxyethylamino)pyrimidine-2-carbonitrile
CID 44565819
6-Ethoxymethyl-5,6,7,8-tetrahydro-pteridine-2,4-diamine
CID 10680655
4-Morpholin-4-yl-6-pyrrolidin-1-ylpyrimidin-5-amine
CID 19137246

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-(cyclopentylamino)-6-morpholin-4-ylpyrimidine-2-carbonitrile?
The IUPAC name of 5-amino-4-(cyclopentylamino)-6-morpholin-4-ylpyrimidine-2-carbonitrile (CID 44565778) is 5-amino-4-(cyclopentylamino)-6-morpholin-4-ylpyrimidine-2-carbonitrile.
What is the SMILES notation for 5-amino-4-(cyclopentylamino)-6-morpholin-4-ylpyrimidine-2-carbonitrile?
The canonical SMILES for 5-amino-4-(cyclopentylamino)-6-morpholin-4-ylpyrimidine-2-carbonitrile is N#Cc1nc(NC2CCCC2)c(N)c(N2CCOCC2)n1.
What is the InChIKey of 5-amino-4-(cyclopentylamino)-6-morpholin-4-ylpyrimidine-2-carbonitrile?
The InChIKey is WFZYTAPCBPHQFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6O/c15-9-11-18-13(17-10-3-1-2-4-10)12(16)14(19-11)20-5-7-21-8-6-20/h10H,1-8,16H2,(H,17,18,19).
What are the key properties of 5-amino-4-(cyclopentylamino)-6-morpholin-4-ylpyrimidine-2-carbonitrile?
5-amino-4-(cyclopentylamino)-6-morpholin-4-ylpyrimidine-2-carbonitrile has a molecular weight of 288.35 g/mol, XLogP of 1.12, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-(cyclopentylamino)-6-morpholin-4-ylpyrimidine-2-carbonitrile is sourced from PubChem (CID 44565778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).