1-[2-(oxolan-2-ylmethyl)pyrimidin-5-yl]propan-2-amine

C12H19N3O — CID 62756821

IUPAC1-[2-(oxolan-2-ylmethyl)pyrimidin-5-yl]propan-2-amine
SMILESCC(N)Cc1cnc(CC2CCCO2)nc1
InChIInChI=1S/C12H19N3O/c1-9(13)5-10-7-14-12(15-8-10)6-11-3-2-4-16-11/h7-9,11H,2-6,13H2,1H3
InChIKeyNQCAZJRDAXCYPL-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.09
Rot. Bonds4

About 1-[2-(oxolan-2-ylmethyl)pyrimidin-5-yl]propan-2-amine

1-[2-(oxolan-2-ylmethyl)pyrimidin-5-yl]propan-2-amine (PubChem CID 62756821) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 1-[2-(oxolan-2-ylmethyl)pyrimidin-5-yl]propan-2-amine.

Molecular Properties

Compound Name1-[2-(oxolan-2-ylmethyl)pyrimidin-5-yl]propan-2-amine
PubChem CID62756821
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name1-[2-(oxolan-2-ylmethyl)pyrimidin-5-yl]propan-2-amine
SMILESCC(N)Cc1cnc(CC2CCCO2)nc1
InChIInChI=1S/C12H19N3O/c1-9(13)5-10-7-14-12(15-8-10)6-11-3-2-4-16-11/h7-9,11H,2-6,13H2,1H3
InChIKeyNQCAZJRDAXCYPL-UHFFFAOYSA-N
XLogP1.09
TPSA61.03 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 ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(oxolan-2-ylmethyl)pyrimidin-5-amine
CID 43142229
N-[[2-(oxolan-2-ylmethyl)pyrimidin-5-yl]methyl]propan-1-amine
CID 62756957
1-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]propan-2-amine
CID 62730979
1-[3,5-dimethoxy-4-(oxolan-2-ylmethoxy)phenyl]propan-2-amine
CID 60906720
1-[5-(oxolan-2-ylmethyl)-1,3-oxazol-2-yl]ethanamine
CID 65178634
N-methyl-1-[2-(oxolan-2-ylmethyl)-1,3-thiazol-5-yl]propan-2-amine
CID 115090839
1-[2,5-dimethoxy-4-(oxolan-2-ylmethyl)phenyl]propan-2-amine;hydrochloride
CID 69399771
1-[4-[2-(oxolan-2-yl)ethoxy]phenyl]propan-2-amine
CID 65164633
4-(2-aminopropyl)-N-(oxolan-2-ylmethyl)aniline
CID 143867362
1-[3-methoxy-2-(oxolan-2-ylmethoxy)phenyl]propan-2-amine
CID 60907628
(2R)-1-(oxolan-2-yl)propan-2-amine
CID 104932128
2,2-dimethyl-1-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]propan-1-amine
CID 43470381

Frequently Asked Questions

What is the IUPAC name of 1-[2-(oxolan-2-ylmethyl)pyrimidin-5-yl]propan-2-amine?
The IUPAC name of 1-[2-(oxolan-2-ylmethyl)pyrimidin-5-yl]propan-2-amine (CID 62756821) is 1-[2-(oxolan-2-ylmethyl)pyrimidin-5-yl]propan-2-amine.
What is the SMILES notation for 1-[2-(oxolan-2-ylmethyl)pyrimidin-5-yl]propan-2-amine?
The canonical SMILES for 1-[2-(oxolan-2-ylmethyl)pyrimidin-5-yl]propan-2-amine is CC(N)Cc1cnc(CC2CCCO2)nc1.
What is the InChIKey of 1-[2-(oxolan-2-ylmethyl)pyrimidin-5-yl]propan-2-amine?
The InChIKey is NQCAZJRDAXCYPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-9(13)5-10-7-14-12(15-8-10)6-11-3-2-4-16-11/h7-9,11H,2-6,13H2,1H3.
What are the key properties of 1-[2-(oxolan-2-ylmethyl)pyrimidin-5-yl]propan-2-amine?
1-[2-(oxolan-2-ylmethyl)pyrimidin-5-yl]propan-2-amine has a molecular weight of 221.30 g/mol, XLogP of 1.09, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(oxolan-2-ylmethyl)pyrimidin-5-yl]propan-2-amine is sourced from PubChem (CID 62756821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).