[1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol

C15H24N4O — CID 80967620

IUPAC[1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol
SMILESCCNc1cc(N2CCCC(CO)C2)nc(C2CC2)n1
InChIInChI=1S/C15H24N4O/c1-2-16-13-8-14(18-15(17-13)12-5-6-12)19-7-3-4-11(9-19)10-20/h8,11-12,20H,2-7,9-10H2,1H3,(H,16,17,18)
InChIKeySYHMDDHHWNHTCX-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.99
Rot. Bonds5

About [1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol

[1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol (PubChem CID 80967620) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is [1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol.

Molecular Properties

Compound Name[1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol
PubChem CID80967620
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name[1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol
SMILESCCNc1cc(N2CCCC(CO)C2)nc(C2CC2)n1
InChIInChI=1S/C15H24N4O/c1-2-16-13-8-14(18-15(17-13)12-5-6-12)19-7-3-4-11(9-19)10-20/h8,11-12,20H,2-7,9-10H2,1H3,(H,16,17,18)
InChIKeySYHMDDHHWNHTCX-UHFFFAOYSA-N
XLogP1.99
TPSA61.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[1-[2-ethyl-6-(methylamino)pyrimidin-4-yl]piperidin-3-yl]methanol
CID 80933961
2-cyclopropyl-N-ethyl-6-(2-methylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80967631
1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide
CID 80956690
[1-[6-(methylamino)-2-methylsulfanylpyrimidin-4-yl]piperidin-3-yl]methanol
CID 80792404
[1-[6-(ethylamino)-2-methylpyrimidin-4-yl]piperidin-4-yl]methanol
CID 80757736
2-cyclopropyl-6-(4-ethylazepan-1-yl)-N-methylpyrimidin-4-amine
CID 80959321
[1-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methanol
CID 80964876
1-[6-(ethylamino)-2-propylpyrimidin-4-yl]piperidin-3-ol
CID 80955342
4-N-(cyclobutylmethyl)-2-cyclopropyl-6-N-ethylpyrimidine-4,6-diamine
CID 80968066
[1-[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]piperidin-3-yl]methanol
CID 113380422
[1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol
CID 80793310
N-ethyl-6-(4-ethylazepan-1-yl)-2-propylpyrimidin-4-amine
CID 80944664

Frequently Asked Questions

What is the IUPAC name of [1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol?
The IUPAC name of [1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol (CID 80967620) is [1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol.
What is the SMILES notation for [1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol?
The canonical SMILES for [1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol is CCNc1cc(N2CCCC(CO)C2)nc(C2CC2)n1.
What is the InChIKey of [1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol?
The InChIKey is SYHMDDHHWNHTCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-2-16-13-8-14(18-15(17-13)12-5-6-12)19-7-3-4-11(9-19)10-20/h8,11-12,20H,2-7,9-10H2,1H3,(H,16,17,18).
What are the key properties of [1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol?
[1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol has a molecular weight of 276.38 g/mol, XLogP of 1.99, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol is sourced from PubChem (CID 80967620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).