1-[6-(ethylamino)-2-propylpyrimidin-4-yl]piperidin-3-ol

C14H24N4O — CID 80955342

IUPAC1-[6-(ethylamino)-2-propylpyrimidin-4-yl]piperidin-3-ol
SMILESCCCc1nc(NCC)cc(N2CCCC(O)C2)n1
InChIInChI=1S/C14H24N4O/c1-3-6-12-16-13(15-4-2)9-14(17-12)18-8-5-7-11(19)10-18/h9,11,19H,3-8,10H2,1-2H3,(H,15,16,17)
InChIKeyIJBCYWQKCCQQQS-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.82
Rot. Bonds5

About 1-[6-(ethylamino)-2-propylpyrimidin-4-yl]piperidin-3-ol

1-[6-(ethylamino)-2-propylpyrimidin-4-yl]piperidin-3-ol (PubChem CID 80955342) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[6-(ethylamino)-2-propylpyrimidin-4-yl]piperidin-3-ol.

Molecular Properties

Compound Name1-[6-(ethylamino)-2-propylpyrimidin-4-yl]piperidin-3-ol
PubChem CID80955342
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name1-[6-(ethylamino)-2-propylpyrimidin-4-yl]piperidin-3-ol
SMILESCCCc1nc(NCC)cc(N2CCCC(O)C2)n1
InChIInChI=1S/C14H24N4O/c1-3-6-12-16-13(15-4-2)9-14(17-12)18-8-5-7-11(19)10-18/h9,11,19H,3-8,10H2,1-2H3,(H,15,16,17)
InChIKeyIJBCYWQKCCQQQS-UHFFFAOYSA-N
XLogP1.82
TPSA61.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[6-(ethylamino)-2-propylpyrimidin-4-yl]pyrrolidine-3,4-diol
CID 106674486
N-ethyl-6-(4-ethylazepan-1-yl)-2-propylpyrimidin-4-amine
CID 80944664
N-ethyl-2-propyl-6-(4-propylpiperidin-1-yl)pyrimidin-4-amine
CID 80941270
6-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-N-methyl-2-propylpyrimidin-4-amine
CID 80944630
1-[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]-4-methylpiperidin-3-ol
CID 102971298
1-(6-hydrazinyl-2-propylpyrimidin-4-yl)-N,N-dimethylpiperidin-3-amine
CID 80946979
N-ethyl-2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine
CID 80940402
N,2-diethyl-6-(3-methylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80933054
1-[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]-3-methylpiperidin-4-ol
CID 114683910
6-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-methyl-2-propylpyrimidin-4-amine
CID 80950038
N-ethyl-6-(2-ethylazepan-1-yl)-2-propylpyrimidin-4-amine
CID 104693100
N-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-2-propylpyrimidin-4-amine
CID 107396346

Frequently Asked Questions

What is the IUPAC name of 1-[6-(ethylamino)-2-propylpyrimidin-4-yl]piperidin-3-ol?
The IUPAC name of 1-[6-(ethylamino)-2-propylpyrimidin-4-yl]piperidin-3-ol (CID 80955342) is 1-[6-(ethylamino)-2-propylpyrimidin-4-yl]piperidin-3-ol.
What is the SMILES notation for 1-[6-(ethylamino)-2-propylpyrimidin-4-yl]piperidin-3-ol?
The canonical SMILES for 1-[6-(ethylamino)-2-propylpyrimidin-4-yl]piperidin-3-ol is CCCc1nc(NCC)cc(N2CCCC(O)C2)n1.
What is the InChIKey of 1-[6-(ethylamino)-2-propylpyrimidin-4-yl]piperidin-3-ol?
The InChIKey is IJBCYWQKCCQQQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-6-12-16-13(15-4-2)9-14(17-12)18-8-5-7-11(19)10-18/h9,11,19H,3-8,10H2,1-2H3,(H,15,16,17).
What are the key properties of 1-[6-(ethylamino)-2-propylpyrimidin-4-yl]piperidin-3-ol?
1-[6-(ethylamino)-2-propylpyrimidin-4-yl]piperidin-3-ol has a molecular weight of 264.37 g/mol, XLogP of 1.82, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(ethylamino)-2-propylpyrimidin-4-yl]piperidin-3-ol is sourced from PubChem (CID 80955342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).