6-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine

C12H19N3O — CID 61241083

IUPAC6-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine
SMILESCCc1cc(NCCC2CCCO2)ncn1
InChIInChI=1S/C12H19N3O/c1-2-10-8-12(15-9-14-10)13-6-5-11-4-3-7-16-11/h8-9,11H,2-7H2,1H3,(H,13,14,15)
InChIKeyHECILJQVLPUGLQ-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.02
Rot. Bonds5

About 6-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine

6-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine (PubChem CID 61241083) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 6-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine
PubChem CID61241083
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name6-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine
SMILESCCc1cc(NCCC2CCCO2)ncn1
InChIInChI=1S/C12H19N3O/c1-2-10-8-12(15-9-14-10)13-6-5-11-4-3-7-16-11/h8-9,11H,2-7H2,1H3,(H,13,14,15)
InChIKeyHECILJQVLPUGLQ-UHFFFAOYSA-N
XLogP2.02
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
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

6-ethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine
CID 104973152
4-N,6-N-bis(oxolan-2-ylmethyl)pyrimidine-4,6-diamine
CID 112857188
6-chloro-2-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine
CID 80936355
4-N-[2-(oxolan-2-yl)ethyl]-6-N-propylpyrimidine-2,4,6-triamine
CID 80811963
4-N-(4-ethylphenyl)-6-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine
CID 112857276
4-ethyl-2-[6-[2-[(2S)-oxolan-2-yl]ethylamino]-3-pyridinyl]-1H-pyrimidin-6-one
CID 136714200
5-methyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-2-amine
CID 63208180
2-N-[2-(oxolan-2-yl)ethyl]pyrazine-2,5-diamine
CID 80652214
N-(2-cyclopentylethyl)-6-propylpyrimidin-4-amine
CID 61241874
6-hydrazinyl-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine
CID 80904049
N-(3-cyclopentyloxypropyl)-6-ethylpyrimidin-4-amine
CID 72941041
5-bromo-N-[2-(oxolan-2-yl)ethyl]pyridin-2-amine
CID 61039267

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine?
The IUPAC name of 6-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine (CID 61241083) is 6-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine?
The canonical SMILES for 6-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine is CCc1cc(NCCC2CCCO2)ncn1.
What is the InChIKey of 6-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine?
The InChIKey is HECILJQVLPUGLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-2-10-8-12(15-9-14-10)13-6-5-11-4-3-7-16-11/h8-9,11H,2-7H2,1H3,(H,13,14,15).
What are the key properties of 6-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine?
6-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine has a molecular weight of 221.30 g/mol, XLogP of 2.02, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine is sourced from PubChem (CID 61241083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).