[2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol

C16H28N4O — CID 80959683

IUPAC[2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol
SMILESCCNc1cc(NCC2CCCC2CO)nc(C(C)C)n1
InChIInChI=1S/C16H28N4O/c1-4-17-14-8-15(20-16(19-14)11(2)3)18-9-12-6-5-7-13(12)10-21/h8,11-13,21H,4-7,9-10H2,1-3H3,(H2,17,18,19,20)
InChIKeyOSCPLUFOSVDIGC-UHFFFAOYSA-N
MW292.43 g/mol
LogP2.85
Rot. Bonds7

About [2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol

[2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol (PubChem CID 80959683) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is [2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol
PubChem CID80959683
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC Name[2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol
SMILESCCNc1cc(NCC2CCCC2CO)nc(C(C)C)n1
InChIInChI=1S/C16H28N4O/c1-4-17-14-8-15(20-16(19-14)11(2)3)18-9-12-6-5-7-13(12)10-21/h8,11-13,21H,4-7,9-10H2,1-3H3,(H2,17,18,19,20)
InChIKeyOSCPLUFOSVDIGC-UHFFFAOYSA-N
XLogP2.85
TPSA70.07 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 52.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze [2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol with MolForge

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Related Compounds

4-N-(cyclohexylmethyl)-6-N-ethyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 80967492
6-N-methyl-4-N-[(2-methylcyclohexyl)methyl]-2-propan-2-ylpyrimidine-4,6-diamine
CID 80961821
6-methyl-N-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpyrimidin-4-amine
CID 107419098
[2-[[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclohexyl]methanol
CID 80856232
1-cyclopropyl-2-[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]ethanol
CID 80958153
2-[[(6-chloro-2-propan-2-ylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 80951072
[2-[[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]methyl]cyclohexyl]methanol
CID 80937943
[2-[[(6-amino-2-methylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 80855981
[2-[[(6-ethoxy-2-methylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 66326317
[2-[[[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]amino]methyl]cyclopentyl]methanol
CID 106772357
6-N-ethyl-2-methyl-4-N-[(2-methylcyclopentyl)methyl]pyrimidine-4,6-diamine
CID 107421241
5-[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]-2-methylpentan-1-ol
CID 106163373

Frequently Asked Questions

What is the IUPAC name of [2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol?
The IUPAC name of [2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol (CID 80959683) is [2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol.
What is the SMILES notation for [2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol?
The canonical SMILES for [2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol is CCNc1cc(NCC2CCCC2CO)nc(C(C)C)n1.
What is the InChIKey of [2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol?
The InChIKey is OSCPLUFOSVDIGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O/c1-4-17-14-8-15(20-16(19-14)11(2)3)18-9-12-6-5-7-13(12)10-21/h8,11-13,21H,4-7,9-10H2,1-3H3,(H2,17,18,19,20).
What are the key properties of [2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol?
[2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol has a molecular weight of 292.43 g/mol, XLogP of 2.85, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol is sourced from PubChem (CID 80959683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).