N-(5-bromo-3-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide

C15H21BrN2O — CID 114223341

IUPACN-(5-bromo-3-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
SMILESCC(C)CC1(C(=O)Nc2cncc(Br)c2)CCCC1
InChIInChI=1S/C15H21BrN2O/c1-11(2)8-15(5-3-4-6-15)14(19)18-13-7-12(16)9-17-10-13/h7,9-11H,3-6,8H2,1-2H3,(H,18,19)
InChIKeyGFZJSNGSVXCFOS-UHFFFAOYSA-N
MW325.25 g/mol
LogP4.39
Rot. Bonds4

About N-(5-bromo-3-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide

N-(5-bromo-3-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide (PubChem CID 114223341) has the molecular formula C15H21BrN2O and a molecular weight of 325.25 g/mol. Its IUPAC name is N-(5-bromo-3-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(5-bromo-3-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
PubChem CID114223341
Molecular FormulaC15H21BrN2O
Molecular Weight325.25 g/mol
Exact Mass324.08
IUPAC NameN-(5-bromo-3-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
SMILESCC(C)CC1(C(=O)Nc2cncc(Br)c2)CCCC1
InChIInChI=1S/C15H21BrN2O/c1-11(2)8-15(5-3-4-6-15)14(19)18-13-7-12(16)9-17-10-13/h7,9-11H,3-6,8H2,1-2H3,(H,18,19)
InChIKeyGFZJSNGSVXCFOS-UHFFFAOYSA-N
XLogP4.39
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.25
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(bromomethyl)phenyl]-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 114307329
2-(1-aminocyclohexyl)-N-(5-bromo-3-pyridinyl)acetamide
CID 114222291
N-(5-bromo-3-pyridinyl)-2,2-dimethylcyclopropane-1-carboxamide
CID 130164401
1-(2-methylpropyl)-N-(5-propan-2-yl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide
CID 104619916
2-methyl-2-[4-[[1-(2-methylpropyl)cyclobutanecarbonyl]amino]pyrazol-1-yl]propanoic acid
CID 120697304
N-(5-tert-butyl-1H-pyrazol-3-yl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 104620031
(2S)-2-[(5-bromo-3-pyridinyl)carbamoylamino]-4-methylpentanoic acid
CID 114222532
N-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 113456865
N-(5-bromo-3-pyridinyl)-4-cyanooxane-4-carboxamide
CID 113339574
1-(aminomethyl)-N-pyrimidin-5-ylcyclopentane-1-carboxamide
CID 107588384
N-(5-bromo-3-pyridinyl)-2-methoxyacetamide
CID 130164423
[1-[(5-bromo-3-pyridinyl)amino]cyclopentyl]methanol
CID 90272593

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-3-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide?
The IUPAC name of N-(5-bromo-3-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide (CID 114223341) is N-(5-bromo-3-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide.
What is the SMILES notation for N-(5-bromo-3-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide?
The canonical SMILES for N-(5-bromo-3-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide is CC(C)CC1(C(=O)Nc2cncc(Br)c2)CCCC1.
What is the InChIKey of N-(5-bromo-3-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide?
The InChIKey is GFZJSNGSVXCFOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21BrN2O/c1-11(2)8-15(5-3-4-6-15)14(19)18-13-7-12(16)9-17-10-13/h7,9-11H,3-6,8H2,1-2H3,(H,18,19).
What are the key properties of N-(5-bromo-3-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide?
N-(5-bromo-3-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide has a molecular weight of 325.25 g/mol, XLogP of 4.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-3-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 114223341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).