2-cyclohexyl-5-[1-(2-propan-2-yloxyethyl)imidazol-2-yl]pyrimidine

C18H26N4O — CID 56862482

IUPAC2-cyclohexyl-5-[1-(2-propan-2-yloxyethyl)imidazol-2-yl]pyrimidine
SMILESCC(C)OCCn1ccnc1-c1cnc(C2CCCCC2)nc1
InChIInChI=1S/C18H26N4O/c1-14(2)23-11-10-22-9-8-19-18(22)16-12-20-17(21-13-16)15-6-4-3-5-7-15/h8-9,12-15H,3-7,10-11H2,1-2H3
InChIKeyXXRBNJIBLULEDW-UHFFFAOYSA-N
MW314.43 g/mol
LogP3.81
Rot. Bonds6

About 2-cyclohexyl-5-[1-(2-propan-2-yloxyethyl)imidazol-2-yl]pyrimidine

2-cyclohexyl-5-[1-(2-propan-2-yloxyethyl)imidazol-2-yl]pyrimidine (PubChem CID 56862482) has the molecular formula C18H26N4O and a molecular weight of 314.43 g/mol. Its IUPAC name is 2-cyclohexyl-5-[1-(2-propan-2-yloxyethyl)imidazol-2-yl]pyrimidine.

Molecular Properties

Compound Name2-cyclohexyl-5-[1-(2-propan-2-yloxyethyl)imidazol-2-yl]pyrimidine
PubChem CID56862482
Molecular FormulaC18H26N4O
Molecular Weight314.43 g/mol
Exact Mass314.21
IUPAC Name2-cyclohexyl-5-[1-(2-propan-2-yloxyethyl)imidazol-2-yl]pyrimidine
SMILESCC(C)OCCn1ccnc1-c1cnc(C2CCCCC2)nc1
InChIInChI=1S/C18H26N4O/c1-14(2)23-11-10-22-9-8-19-18(22)16-12-20-17(21-13-16)15-6-4-3-5-7-15/h8-9,12-15H,3-7,10-11H2,1-2H3
InChIKeyXXRBNJIBLULEDW-UHFFFAOYSA-N
XLogP3.81
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2-{2-[2-(methoxymethyl)pyrimidin-5-yl]-1H-imidazol-1-yl}ethyl)dimethylamine
CID 56867185
(3R,4S)-1-[[2-(methoxymethyl)pyrimidin-5-yl]methyl]-N,N-dimethyl-4-propylpyrrolidin-3-amine
CID 72861496
5-[[ethyl-[(1-methylimidazol-2-yl)methyl]amino]methyl]-N-[[(2R)-oxolan-2-yl]methyl]pyrimidin-2-amine
CID 99946648
2-methoxy-5-[[(3S)-3-[(2-methylimidazol-1-yl)methyl]piperidin-1-yl]methyl]pyrimidine
CID 164632310
4-{5-fluoro-2-[3-(1-isopropyl-1H-imidazol-2-yl)-1-piperidinyl]-4-pyrimidinyl}morpholine
CID 72840504
5-fluoro-2-{3-[1-(2-methoxyethyl)-1H-imidazol-2-yl]piperidin-1-yl}-N,N-dimethylpyrimidin-4-amine
CID 72897039
4-{5-fluoro-2-[3-(1H-imidazol-1-ylmethyl)-1-piperidinyl]-4-pyrimidinyl}morpholine
CID 72937447
4-[5-fluoro-2-[(3R)-3-(1-propan-2-ylimidazol-2-yl)piperidin-1-yl]pyrimidin-4-yl]morpholine
CID 97187351
4-[5-fluoro-2-[(3S)-3-(1-propan-2-ylimidazol-2-yl)piperidin-1-yl]pyrimidin-4-yl]morpholine
CID 97187352
5-fluoro-2-[(3S)-3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-N,N-dimethylpyrimidin-4-amine
CID 97278798
5-fluoro-2-[(3R)-3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-N,N-dimethylpyrimidin-4-amine
CID 97278799
4-(5-Fluoropyrimidin-2-yl)-9-[(1-methylimidazol-2-yl)methyl]-1-oxa-4,9-diazaspiro[5.5]undecane
CID 97451012

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-5-[1-(2-propan-2-yloxyethyl)imidazol-2-yl]pyrimidine?
The IUPAC name of 2-cyclohexyl-5-[1-(2-propan-2-yloxyethyl)imidazol-2-yl]pyrimidine (CID 56862482) is 2-cyclohexyl-5-[1-(2-propan-2-yloxyethyl)imidazol-2-yl]pyrimidine.
What is the SMILES notation for 2-cyclohexyl-5-[1-(2-propan-2-yloxyethyl)imidazol-2-yl]pyrimidine?
The canonical SMILES for 2-cyclohexyl-5-[1-(2-propan-2-yloxyethyl)imidazol-2-yl]pyrimidine is CC(C)OCCn1ccnc1-c1cnc(C2CCCCC2)nc1.
What is the InChIKey of 2-cyclohexyl-5-[1-(2-propan-2-yloxyethyl)imidazol-2-yl]pyrimidine?
The InChIKey is XXRBNJIBLULEDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O/c1-14(2)23-11-10-22-9-8-19-18(22)16-12-20-17(21-13-16)15-6-4-3-5-7-15/h8-9,12-15H,3-7,10-11H2,1-2H3.
What are the key properties of 2-cyclohexyl-5-[1-(2-propan-2-yloxyethyl)imidazol-2-yl]pyrimidine?
2-cyclohexyl-5-[1-(2-propan-2-yloxyethyl)imidazol-2-yl]pyrimidine has a molecular weight of 314.43 g/mol, XLogP of 3.81, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-5-[1-(2-propan-2-yloxyethyl)imidazol-2-yl]pyrimidine is sourced from PubChem (CID 56862482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).