N-(2-methyloxolan-3-yl)-4-propan-2-yloxypyrimidin-2-amine

C12H19N3O2 — CID 112638391

IUPACN-(2-methyloxolan-3-yl)-4-propan-2-yloxypyrimidin-2-amine
SMILESCC(C)Oc1ccnc(NC2CCOC2C)n1
InChIInChI=1S/C12H19N3O2/c1-8(2)17-11-4-6-13-12(15-11)14-10-5-7-16-9(10)3/h4,6,8-10H,5,7H2,1-3H3,(H,13,14,15)
InChIKeyXZUBOWNABKTPAF-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.85
Rot. Bonds4

About N-(2-methyloxolan-3-yl)-4-propan-2-yloxypyrimidin-2-amine

N-(2-methyloxolan-3-yl)-4-propan-2-yloxypyrimidin-2-amine (PubChem CID 112638391) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is N-(2-methyloxolan-3-yl)-4-propan-2-yloxypyrimidin-2-amine.

Molecular Properties

Compound NameN-(2-methyloxolan-3-yl)-4-propan-2-yloxypyrimidin-2-amine
PubChem CID112638391
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC NameN-(2-methyloxolan-3-yl)-4-propan-2-yloxypyrimidin-2-amine
SMILESCC(C)Oc1ccnc(NC2CCOC2C)n1
InChIInChI=1S/C12H19N3O2/c1-8(2)17-11-4-6-13-12(15-11)14-10-5-7-16-9(10)3/h4,6,8-10H,5,7H2,1-3H3,(H,13,14,15)
InChIKeyXZUBOWNABKTPAF-UHFFFAOYSA-N
XLogP1.85
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-N-(2-methyloxolan-3-yl)pyrimidin-2-amine
CID 112547989
N-(2-methyloxan-4-yl)-4-propan-2-yloxypyrimidin-2-amine
CID 114108395
2-N-(2-methyloxolan-3-yl)pyrimidine-2,4-diamine
CID 116797194
N-[2-(chloromethyl)cyclohexyl]-4-propan-2-yloxypyrimidin-2-amine
CID 106365613
N-[(4S)-4-methoxypyrrolidin-3-yl]-4-propan-2-yloxypyrimidin-2-amine
CID 113357061
N-[2-(4-methylcyclohexyl)ethyl]-4-propan-2-yloxypyrimidin-2-amine
CID 115975097
N-(1-cyclopropylpropan-2-yl)-4-propan-2-yloxypyrimidin-2-amine
CID 112637761
N-(2-methyloxolan-3-yl)-2-propan-2-yloxypyridin-3-amine
CID 82727184
N-(2,2-dicyclopropylethyl)-4-propan-2-yloxypyrimidin-2-amine
CID 112638038
2-methyl-3-[[(4-propan-2-yloxypyrimidin-2-yl)amino]methyl]oxolan-3-ol
CID 106102253
(1R,3R)-1-[(4-propan-2-yloxypyrimidin-2-yl)amino]-7-oxaspiro[3.5]nonan-3-ol
CID 167870410
3-[(4-propan-2-yloxypyrimidin-2-yl)amino]piperidine-2,6-dione
CID 112638088

Frequently Asked Questions

What is the IUPAC name of N-(2-methyloxolan-3-yl)-4-propan-2-yloxypyrimidin-2-amine?
The IUPAC name of N-(2-methyloxolan-3-yl)-4-propan-2-yloxypyrimidin-2-amine (CID 112638391) is N-(2-methyloxolan-3-yl)-4-propan-2-yloxypyrimidin-2-amine.
What is the SMILES notation for N-(2-methyloxolan-3-yl)-4-propan-2-yloxypyrimidin-2-amine?
The canonical SMILES for N-(2-methyloxolan-3-yl)-4-propan-2-yloxypyrimidin-2-amine is CC(C)Oc1ccnc(NC2CCOC2C)n1.
What is the InChIKey of N-(2-methyloxolan-3-yl)-4-propan-2-yloxypyrimidin-2-amine?
The InChIKey is XZUBOWNABKTPAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-8(2)17-11-4-6-13-12(15-11)14-10-5-7-16-9(10)3/h4,6,8-10H,5,7H2,1-3H3,(H,13,14,15).
What are the key properties of N-(2-methyloxolan-3-yl)-4-propan-2-yloxypyrimidin-2-amine?
N-(2-methyloxolan-3-yl)-4-propan-2-yloxypyrimidin-2-amine has a molecular weight of 237.30 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyloxolan-3-yl)-4-propan-2-yloxypyrimidin-2-amine is sourced from PubChem (CID 112638391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).