N-(2-methyloxolan-3-yl)-6-propylpyrimidin-4-amine

C12H19N3O — CID 82728065

IUPACN-(2-methyloxolan-3-yl)-6-propylpyrimidin-4-amine
SMILESCCCc1cc(NC2CCOC2C)ncn1
InChIInChI=1S/C12H19N3O/c1-3-4-10-7-12(14-8-13-10)15-11-5-6-16-9(11)2/h7-9,11H,3-6H2,1-2H3,(H,13,14,15)
InChIKeyXJGCBRFVAWWJBO-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.02
Rot. Bonds4

About N-(2-methyloxolan-3-yl)-6-propylpyrimidin-4-amine

N-(2-methyloxolan-3-yl)-6-propylpyrimidin-4-amine (PubChem CID 82728065) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-(2-methyloxolan-3-yl)-6-propylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(2-methyloxolan-3-yl)-6-propylpyrimidin-4-amine
PubChem CID82728065
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-(2-methyloxolan-3-yl)-6-propylpyrimidin-4-amine
SMILESCCCc1cc(NC2CCOC2C)ncn1
InChIInChI=1S/C12H19N3O/c1-3-4-10-7-12(14-8-13-10)15-11-5-6-16-9(11)2/h7-9,11H,3-6H2,1-2H3,(H,13,14,15)
InChIKeyXJGCBRFVAWWJBO-UHFFFAOYSA-N
XLogP2.02
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N,6-N-bis(2-methyloxolan-3-yl)pyrimidine-4,6-diamine
CID 86797851
N-(2-methylcyclopropyl)-6-propylpyrimidin-4-amine
CID 62398962
6-methyl-N-(2-methyloxolan-3-yl)pyrimidin-4-amine
CID 82728623
4-N-(2-methyloxolan-3-yl)-2-propylpyrimidine-4,6-diamine
CID 82736136
N-(6-propylpyrimidin-4-yl)azepan-4-amine
CID 107173664
N-(2-cyclopentylethyl)-6-propylpyrimidin-4-amine
CID 61241874
N-(cyclobutylmethyl)-6-propylpyrimidin-4-amine
CID 61241873
4-bromo-N-(2-methyloxolan-3-yl)pyridin-2-amine
CID 130891045
N-(3-ethylsulfanylcyclopentyl)-6-propylpyrimidin-4-amine
CID 114124106
9-methyl-N-(6-propylpyrimidin-4-yl)-9-azabicyclo[3.3.1]nonan-3-amine
CID 65470895
N-(6-propylpyrimidin-4-yl)morpholin-4-amine
CID 83026460
N-(3-chloro-2,2-dimethylcyclobutyl)-6-propylpyrimidin-4-amine
CID 114632109

Frequently Asked Questions

What is the IUPAC name of N-(2-methyloxolan-3-yl)-6-propylpyrimidin-4-amine?
The IUPAC name of N-(2-methyloxolan-3-yl)-6-propylpyrimidin-4-amine (CID 82728065) is N-(2-methyloxolan-3-yl)-6-propylpyrimidin-4-amine.
What is the SMILES notation for N-(2-methyloxolan-3-yl)-6-propylpyrimidin-4-amine?
The canonical SMILES for N-(2-methyloxolan-3-yl)-6-propylpyrimidin-4-amine is CCCc1cc(NC2CCOC2C)ncn1.
What is the InChIKey of N-(2-methyloxolan-3-yl)-6-propylpyrimidin-4-amine?
The InChIKey is XJGCBRFVAWWJBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-3-4-10-7-12(14-8-13-10)15-11-5-6-16-9(11)2/h7-9,11H,3-6H2,1-2H3,(H,13,14,15).
What are the key properties of N-(2-methyloxolan-3-yl)-6-propylpyrimidin-4-amine?
N-(2-methyloxolan-3-yl)-6-propylpyrimidin-4-amine has a molecular weight of 221.30 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyloxolan-3-yl)-6-propylpyrimidin-4-amine is sourced from PubChem (CID 82728065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).