8-cyclopropyl-6-methyl-2-morpholin-4-ylpteridin-7-one

C14H17N5O2 — CID 3233384

IUPAC8-cyclopropyl-6-methyl-2-morpholin-4-ylpteridin-7-one
SMILESCc1nc2cnc(N3CCOCC3)nc2n(C2CC2)c1=O
InChIInChI=1S/C14H17N5O2/c1-9-13(20)19(10-2-3-10)12-11(16-9)8-15-14(17-12)18-4-6-21-7-5-18/h8,10H,2-7H2,1H3
InChIKeyWIADBVVNKACMQT-UHFFFAOYSA-N
MW287.32 g/mol
LogP0.67
Rot. Bonds2

About 8-cyclopropyl-6-methyl-2-morpholin-4-ylpteridin-7-one

8-cyclopropyl-6-methyl-2-morpholin-4-ylpteridin-7-one (PubChem CID 3233384) has the molecular formula C14H17N5O2 and a molecular weight of 287.32 g/mol. Its IUPAC name is 8-cyclopropyl-6-methyl-2-morpholin-4-ylpteridin-7-one.

Molecular Properties

Compound Name8-cyclopropyl-6-methyl-2-morpholin-4-ylpteridin-7-one
PubChem CID3233384
Molecular FormulaC14H17N5O2
Molecular Weight287.32 g/mol
Exact Mass287.14
IUPAC Name8-cyclopropyl-6-methyl-2-morpholin-4-ylpteridin-7-one
SMILESCc1nc2cnc(N3CCOCC3)nc2n(C2CC2)c1=O
InChIInChI=1S/C14H17N5O2/c1-9-13(20)19(10-2-3-10)12-11(16-9)8-15-14(17-12)18-4-6-21-7-5-18/h8,10H,2-7H2,1H3
InChIKeyWIADBVVNKACMQT-UHFFFAOYSA-N
XLogP0.67
TPSA73.14 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

8-Methyl-2-(4-methylpiperazin-1-yl)pteridin-7-one
CID 3232646
2-Methoxy-8-methylpteridin-7-one
CID 3232856
6,8-Dimethyl-2-piperazin-1-ylpteridin-7-one
CID 3233003
3-(2-Methoxy-6-methyl-7-oxopteridin-8-yl)propanenitrile
CID 3233319
8-Cyclopropyl-2-(ethylamino)-6-methylpteridin-7-one
CID 3233431
8-Cyclopropyl-2-methoxypteridin-7-one
CID 3233786
8-Cyclopropyl-2-methoxy-6-methylpteridin-7-one
CID 3234207
8-(2-Methoxyethyl)-6-methyl-2-morpholin-4-ylpteridin-7-one
CID 3234388
3-[6-Methyl-2-(4-methylpiperazin-1-yl)-7-oxopteridin-8-yl]propanenitrile
CID 3234661
8-Cyclopropyl-2-(4-methylpiperazin-1-yl)pteridin-7-one
CID 3235223
8-Cyclopropyl-2-(dimethylamino)-6-methylpteridin-7-one
CID 3235340
8-(2-Methoxyethyl)-2-(4-methylpiperazin-1-yl)pteridin-7-one
CID 3235519

Frequently Asked Questions

What is the IUPAC name of 8-cyclopropyl-6-methyl-2-morpholin-4-ylpteridin-7-one?
The IUPAC name of 8-cyclopropyl-6-methyl-2-morpholin-4-ylpteridin-7-one (CID 3233384) is 8-cyclopropyl-6-methyl-2-morpholin-4-ylpteridin-7-one.
What is the SMILES notation for 8-cyclopropyl-6-methyl-2-morpholin-4-ylpteridin-7-one?
The canonical SMILES for 8-cyclopropyl-6-methyl-2-morpholin-4-ylpteridin-7-one is Cc1nc2cnc(N3CCOCC3)nc2n(C2CC2)c1=O.
What is the InChIKey of 8-cyclopropyl-6-methyl-2-morpholin-4-ylpteridin-7-one?
The InChIKey is WIADBVVNKACMQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O2/c1-9-13(20)19(10-2-3-10)12-11(16-9)8-15-14(17-12)18-4-6-21-7-5-18/h8,10H,2-7H2,1H3.
What are the key properties of 8-cyclopropyl-6-methyl-2-morpholin-4-ylpteridin-7-one?
8-cyclopropyl-6-methyl-2-morpholin-4-ylpteridin-7-one has a molecular weight of 287.32 g/mol, XLogP of 0.67, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-cyclopropyl-6-methyl-2-morpholin-4-ylpteridin-7-one is sourced from PubChem (CID 3233384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).