N-(oxolan-3-yl)pyrimidin-5-amine

C8H11N3O — CID 83480544

IUPACN-(oxolan-3-yl)pyrimidin-5-amine
SMILESc1ncc(NC2CCOC2)cn1
InChIInChI=1S/C8H11N3O/c1-2-12-5-7(1)11-8-3-9-6-10-4-8/h3-4,6-7,11H,1-2,5H2
InChIKeyBZDRTEGCFMVIFI-UHFFFAOYSA-N
MW165.20 g/mol
LogP0.68
Rot. Bonds2

About N-(oxolan-3-yl)pyrimidin-5-amine

N-(oxolan-3-yl)pyrimidin-5-amine (PubChem CID 83480544) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is N-(oxolan-3-yl)pyrimidin-5-amine.

Molecular Properties

Compound NameN-(oxolan-3-yl)pyrimidin-5-amine
PubChem CID83480544
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC NameN-(oxolan-3-yl)pyrimidin-5-amine
SMILESc1ncc(NC2CCOC2)cn1
InChIInChI=1S/C8H11N3O/c1-2-12-5-7(1)11-8-3-9-6-10-4-8/h3-4,6-7,11H,1-2,5H2
InChIKeyBZDRTEGCFMVIFI-UHFFFAOYSA-N
XLogP0.68
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(oxolan-3-yl)pyridin-3-amine
CID 63331715
N-(3,5-difluorophenyl)oxolan-3-amine
CID 63331468
5-N-(oxolan-3-yl)pyridine-2,5-diamine
CID 80717069
3-N-methyl-5-N-(oxan-3-yl)pyridine-3,5-diamine
CID 104534608
N-(3,4,5-trifluorophenyl)oxolan-3-amine
CID 63335709
2-N-(oxolan-3-yl)pyrazine-2,6-diamine
CID 80714757
N-[(3S)-oxolan-3-yl]pyrimidin-2-amine
CID 175803601
4-N-(oxolan-3-yl)pyridine-3,4-diamine
CID 80717720
2-chloro-N-(oxolan-3-yl)pyridin-4-amine
CID 115486637
N-(4-propan-2-ylcyclohexyl)pyrimidin-5-amine
CID 107588222
N-(1-methylpiperidin-4-yl)pyrimidin-5-amine
CID 83484174
1-(2-methylpropyl)-N-(oxolan-3-yl)pyrazol-4-amine
CID 115777715

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-3-yl)pyrimidin-5-amine?
The IUPAC name of N-(oxolan-3-yl)pyrimidin-5-amine (CID 83480544) is N-(oxolan-3-yl)pyrimidin-5-amine.
What is the SMILES notation for N-(oxolan-3-yl)pyrimidin-5-amine?
The canonical SMILES for N-(oxolan-3-yl)pyrimidin-5-amine is c1ncc(NC2CCOC2)cn1.
What is the InChIKey of N-(oxolan-3-yl)pyrimidin-5-amine?
The InChIKey is BZDRTEGCFMVIFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c1-2-12-5-7(1)11-8-3-9-6-10-4-8/h3-4,6-7,11H,1-2,5H2.
What are the key properties of N-(oxolan-3-yl)pyrimidin-5-amine?
N-(oxolan-3-yl)pyrimidin-5-amine has a molecular weight of 165.20 g/mol, XLogP of 0.68, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-3-yl)pyrimidin-5-amine is sourced from PubChem (CID 83480544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).