3-cyclohexyl-N-(2-cyclopentylpyrimidin-5-yl)-2-fluoropropanamide

C18H26FN3O — CID 166326791

IUPAC3-cyclohexyl-N-(2-cyclopentylpyrimidin-5-yl)-2-fluoropropanamide
SMILESO=C(Nc1cnc(C2CCCC2)nc1)C(F)CC1CCCCC1
InChIInChI=1S/C18H26FN3O/c19-16(10-13-6-2-1-3-7-13)18(23)22-15-11-20-17(21-12-15)14-8-4-5-9-14/h11-14,16H,1-10H2,(H,22,23)
InChIKeyYUGDIADEOURWHM-UHFFFAOYSA-N
MW319.42 g/mol
LogP4.38
Rot. Bonds5

About 3-cyclohexyl-N-(2-cyclopentylpyrimidin-5-yl)-2-fluoropropanamide

3-cyclohexyl-N-(2-cyclopentylpyrimidin-5-yl)-2-fluoropropanamide (PubChem CID 166326791) has the molecular formula C18H26FN3O and a molecular weight of 319.42 g/mol. Its IUPAC name is 3-cyclohexyl-N-(2-cyclopentylpyrimidin-5-yl)-2-fluoropropanamide.

Molecular Properties

Compound Name3-cyclohexyl-N-(2-cyclopentylpyrimidin-5-yl)-2-fluoropropanamide
PubChem CID166326791
Molecular FormulaC18H26FN3O
Molecular Weight319.42 g/mol
Exact Mass319.21
IUPAC Name3-cyclohexyl-N-(2-cyclopentylpyrimidin-5-yl)-2-fluoropropanamide
SMILESO=C(Nc1cnc(C2CCCC2)nc1)C(F)CC1CCCCC1
InChIInChI=1S/C18H26FN3O/c19-16(10-13-6-2-1-3-7-13)18(23)22-15-11-20-17(21-12-15)14-8-4-5-9-14/h11-14,16H,1-10H2,(H,22,23)
InChIKeyYUGDIADEOURWHM-UHFFFAOYSA-N
XLogP4.38
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.42
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(2-cyclohexylpyrimidin-5-yl)-3-[4-[3-(trifluoromethyl)diazirin-3-yl]phenyl]propanamide;2,2,2-trifluoroacetic acid
CID 167832829
2-cyclopentylpyrimidine-5-carbaldehyde
CID 58228458
(2S)-2-amino-3-cyclopentyl-N-[1-(difluoromethyl)pyrazol-4-yl]propanamide
CID 177043357
(3R)-3-amino-4-cyclohexyl-N-(4-fluorophenyl)-2-hydroxybutanamide
CID 54413400
1-cyclopropyl-3-(2-cyclopropylpyrimidin-5-yl)urea
CID 71933502
1-but-2-ynyl-3-(2-cyclopropylpyrimidin-5-yl)urea
CID 99789978
N-(6-amino-3-pyridinyl)-2-(cyclopentylmethyl)butanamide;hydrochloride
CID 119515073
(2S)-2-amino-3-cyclopentyl-N-(1,2-oxazol-4-yl)propanamide
CID 177043206
3-amino-N-(2-cyclopropylpyrimidin-5-yl)pyrazine-2-carboxamide
CID 136525921
N'-(2-cyclobutylpyrimidin-5-yl)ethane-1,2-diamine
CID 117212308
2-cyclopentylpyrimidin-5-ol
CID 20542594
3-cyclohexyl-N-(2-piperidin-1-ylpyrimidin-5-yl)propanamide
CID 122298424

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-(2-cyclopentylpyrimidin-5-yl)-2-fluoropropanamide?
The IUPAC name of 3-cyclohexyl-N-(2-cyclopentylpyrimidin-5-yl)-2-fluoropropanamide (CID 166326791) is 3-cyclohexyl-N-(2-cyclopentylpyrimidin-5-yl)-2-fluoropropanamide.
What is the SMILES notation for 3-cyclohexyl-N-(2-cyclopentylpyrimidin-5-yl)-2-fluoropropanamide?
The canonical SMILES for 3-cyclohexyl-N-(2-cyclopentylpyrimidin-5-yl)-2-fluoropropanamide is O=C(Nc1cnc(C2CCCC2)nc1)C(F)CC1CCCCC1.
What is the InChIKey of 3-cyclohexyl-N-(2-cyclopentylpyrimidin-5-yl)-2-fluoropropanamide?
The InChIKey is YUGDIADEOURWHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26FN3O/c19-16(10-13-6-2-1-3-7-13)18(23)22-15-11-20-17(21-12-15)14-8-4-5-9-14/h11-14,16H,1-10H2,(H,22,23).
What are the key properties of 3-cyclohexyl-N-(2-cyclopentylpyrimidin-5-yl)-2-fluoropropanamide?
3-cyclohexyl-N-(2-cyclopentylpyrimidin-5-yl)-2-fluoropropanamide has a molecular weight of 319.42 g/mol, XLogP of 4.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N-(2-cyclopentylpyrimidin-5-yl)-2-fluoropropanamide is sourced from PubChem (CID 166326791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).